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SLU-PP-915 - CAS 2285432-92-8

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SLU-PP-915 CAS: 2285432-92-8 | Molecular formula: C17H13BFNO3S | Molecular weight: 341.2 g/mol.

Product information

SLU-PP-915 – CAS 2285432-92-8

SLU-PP-915 is supplied by Rexar as a research-grade chemical reference material for analytical chemistry, compound identification and comparative laboratory workflows. SLU-PP-915 is an aromatic boronic acid derivative containing a thiophene carboxamide region, a fluorophenyl-substituted amide group and a phenylboronic acid moiety. Its combination of aromatic, heteroaromatic, boron-containing, fluorinated and amide structural features provides multiple analytical markers suitable for chromatographic, mass-spectrometric and spectroscopic characterisation.

Research-grade material distributed by Rexar within the European Union.

SLU-PP-915 (CAS 2285432-92-8) is supplied in sealed laboratory packaging to support traceability, storage integrity and laboratory handling procedures.

Rexar Technical Compound Datasheet (PDF)

Safety Data Sheet (SDS)

Additional public reference

Molecular structure data and selected physicochemical properties can be consulted via: SLU-PP-915 on PubChem

Comprehensive structural overview

SLU-PP-915 is an organic heteroaromatic compound with the molecular formula C17H13BFNO3S and a molecular weight of approximately 341.2 g/mol. Its molecular architecture contains a thiophene ring positioned between a phenylboronic acid region and a fluorophenyl-substituted carboxamide group.

The structure contains one boron atom, one fluorine atom, one nitrogen atom, three oxygen atoms and one sulfur atom distributed across chemically distinct aromatic, heteroaromatic, boronic acid and amide environments. This combination provides multiple analytical markers suitable for chromatographic, mass-spectrometric and spectroscopic characterisation.

Thiophene core architecture

A defining structural feature of SLU-PP-915 is the presence of a thiophene ring forming the central heteroaromatic region of the molecule. This five-membered sulfur-containing aromatic ring connects the phenylboronic acid portion with the carboxamide-containing aromatic substituent.

The thiophene system provides a chemically distinctive heteroaromatic environment and may contribute characteristic proton, carbon and mass-spectrometric features during comparative compound identification.

Phenylboronic acid architecture

SLU-PP-915 contains a phenylboronic acid moiety attached to the thiophene-containing central framework. The boronic acid functionality introduces a boron atom together with two oxygen-containing hydroxyl environments.

This structural region provides a distinctive elemental and functional-group feature that can assist analytical differentiation from structurally related aromatic compounds lacking boron.

Fluorophenyl carboxamide region

The molecule contains a fluorophenyl-substituted carboxamide region attached to the thiophene ring. This component combines an aromatic fluorophenyl group with an amide functionality containing nitrogen and carbonyl oxygen.

The fluorinated aromatic environment and amide group provide additional markers for NMR, infrared, chromatographic and mass-spectrometric comparison.

Functional group composition

The molecular formula C17H13BFNO3S reflects a structurally diverse molecule containing aromatic and heteroaromatic regions together with boronic acid and amide functionalities.

  • One thiophene ring
  • Two phenyl-derived aromatic regions
  • One boronic acid functionality
  • One carboxamide functionality
  • One boron atom
  • One fluorine atom
  • One nitrogen atom
  • Three oxygen atoms
  • One sulfur atom

The combination of aromatic, heteroaromatic, boron-containing, fluorinated and amide structural elements provides several analytical markers for comparative compound identification.

Boron-containing structural characteristics

SLU-PP-915 contains a single boron atom within its boronic acid functionality. Boronic acid groups represent chemically distinctive structural features frequently evaluated through complementary analytical techniques.

The boron-containing region may influence molecular polarity, intermolecular interactions and analytical behaviour and provides an elemental marker that distinguishes SLU-PP-915 from related non-boron-containing aromatic compounds.

Fluorine substitution characteristics

One fluorine atom is incorporated into the fluorophenyl region of SLU-PP-915. Fluorinated aromatic substitution provides a distinctive structural and elemental feature that can assist analytical identification.

The fluorine substituent may additionally influence neighbouring proton and carbon environments and can provide complementary information during fluorine-sensitive spectroscopic analysis.

Sulfur-containing heteroaromatic region

The thiophene ring introduces one sulfur atom into the molecular framework of SLU-PP-915. This sulfur-containing aromatic heterocycle forms a central linking region between the two substituted aromatic components.

The thiophene environment contributes characteristic heteroaromatic behaviour that may influence chromatographic retention, ultraviolet absorption and mass-spectrometric fragmentation.

Amide functionality

SLU-PP-915 contains a carboxamide group connecting the thiophene region with the fluorophenyl-associated nitrogen environment.

The amide carbonyl and nitrogen provide characteristic polar environments that may contribute to hydrogen bonding, infrared absorption and NMR behaviour.

Aromatic ring characteristics

The structure contains multiple aromatic regions, including phenyl-derived rings and the central thiophene heteroaromatic ring. These components provide several chemically distinct proton and carbon environments.

The aromatic surface area may contribute to ultraviolet absorption and influence chromatographic behaviour under reversed-phase conditions.

Heteroatom environments

SLU-PP-915 contains boron, fluorine, nitrogen, oxygen and sulfur heteroatoms distributed across several chemically distinct structural environments.

The oxygen atoms are associated with the boronic acid and amide functionalities, nitrogen occurs within the amide region, sulfur is incorporated in the thiophene ring and fluorine is attached to an aromatic ring.

Hydrogen-bonding characteristics

The boronic acid and amide functionalities provide potential hydrogen-bond donor and acceptor environments. These polar regions coexist with substantial aromatic surface area.

This combination may influence solvent interactions, sample-preparation characteristics, chromatographic retention and organisation in the solid state.

Molecular polarity and aromatic balance

SLU-PP-915 combines polar boronic acid and amide functionalities with multiple aromatic and heteroaromatic ring systems. The result is a mixed structural profile containing both polar and hydrophobic molecular regions.

This balance is relevant when evaluating solvent selection, sample preparation and chromatographic method development.

Conformational characteristics

The aromatic rings and thiophene core provide relatively rigid structural regions, while the bonds connecting these components permit a degree of rotational flexibility.

This combination of rigid aromatic frameworks and limited conformational freedom may influence solution-state behaviour and chromatographic characteristics.

Chromatographic behaviour

Under reversed-phase liquid chromatographic conditions, retention of SLU-PP-915 may be influenced by its aromatic rings, thiophene core, fluorine substitution, boronic acid functionality and amide group.

Retention time and peak shape may vary according to mobile-phase composition, gradient conditions, stationary-phase chemistry, temperature, pH and sample concentration.

Liquid chromatography considerations

LC-based methods may be used for qualitative identity comparison, purity profiling and retention-time verification of SLU-PP-915 reference material.

The coexistence of aromatic, heteroaromatic and polar functional groups may require optimisation of mobile-phase composition and stationary-phase chemistry for suitable retention and peak symmetry.

Mass spectrometric considerations

With a molecular weight of approximately 341.2 g/mol, SLU-PP-915 falls within a mass range suitable for routine LC-MS analysis. Appropriate ionisation conditions may support detection of molecular or adduct-associated species depending on solvent composition and instrument parameters.

Fragmentation behaviour may involve the thiophene-carboxamide region, fluorophenyl group or boronic acid-associated aromatic portion and may support structural confirmation when compared with authenticated reference data.

NMR spectroscopic considerations

Proton NMR analysis may show characteristic resonances associated with the aromatic phenyl regions, thiophene ring, boronic acid-associated environments and amide proton environment.

Carbon NMR analysis may provide distinguishable signals corresponding to aromatic carbon atoms, thiophene carbons and the amide carbonyl carbon. Fluorine substitution may additionally influence neighbouring carbon and proton resonances.

Fluorine NMR considerations

The presence of one fluorine atom provides an additional structural marker that may be examined using fluorine-sensitive NMR methods where appropriate.

Fluorine-associated resonances can provide complementary information during structural verification and comparison with authenticated reference material.

Boron-related analytical considerations

The boronic acid functionality introduces a boron-containing structural region that may provide complementary analytical information using appropriate boron-sensitive or elemental analytical techniques.

This characteristic may be particularly useful when differentiating SLU-PP-915 from structurally related aromatic and thiophene compounds that do not contain boron.

Infrared spectroscopic considerations

Infrared analysis may reveal absorption features associated with amide carbonyl functionality, boronic acid O-H environments, aromatic C-H bonds and other heteroatom-containing structural regions.

Comparative infrared spectra may provide supplementary structural information when evaluated alongside chromatographic, mass-spectrometric and NMR data.

Ultraviolet detection considerations

The aromatic and heteroaromatic systems of SLU-PP-915 may support ultraviolet-based chromatographic detection. Suitable detection wavelengths should be selected according to measured absorbance characteristics and validated laboratory methods.

The conjugated phenyl and thiophene regions are expected to contribute substantially to the electronic absorption profile of the compound.

Thiophene chromophore characteristics

The thiophene ring forms an important heteroaromatic component within SLU-PP-915 and contributes to the conjugated electronic framework of the molecule.

In combination with the adjacent aromatic rings, the thiophene region provides additional structural and optical markers for comparative analytical identification.

Boronic acid functional characteristics

The boronic acid group contains one boron atom associated with two oxygen-containing hydroxyl environments. This functionality represents one of the most distinctive polar regions in the molecule.

Its presence may affect solvent interactions and sample preparation and should be considered during analytical method development.

Amide carbonyl characteristics

SLU-PP-915 contains one carbonyl group associated with its carboxamide functionality. This carbonyl environment can provide characteristic infrared absorption and carbon NMR features.

The amide region also contributes a nitrogen-containing environment that can influence molecular polarity and ionisation behaviour.

Solid-state considerations

SLU-PP-915 is supplied as a laboratory solid. Solid-state characteristics such as crystallinity, particle morphology, residual moisture and residual solvent content may depend on manufacturing and purification procedures.

Analytical laboratories may use thermal behaviour, powder analysis or spectroscopic comparison as supplementary identity indicators where appropriate.

Chemical identity and registry metadata

  • Product name: SLU-PP-915
  • Chemical name: [3-[5-[(2-fluorophenyl)carbamoyl]thiophen-2-yl]phenyl]boronic acid
  • CAS number: 2285432-92-8
  • PubChem CID: 142532359
  • Molecular formula: C17H13BFNO3S
  • Molecular weight: 341.2 g/mol
  • Material form: Laboratory solid

Analytical laboratory applications

SLU-PP-915 may serve as a qualitative reference compound in structural verification and comparative analytical workflows involving LC-MS, HPLC, NMR and infrared spectroscopy. Laboratory procedures may include retention-time comparison, molecular-weight confirmation and comparative spectral profiling.

  • LC-MS molecular-weight verification
  • HPLC retention-time comparison
  • NMR structural analysis
  • Fluorine-sensitive spectroscopic comparison
  • Comparative evaluation of boron-containing compounds
  • Infrared functional-group comparison
  • Comparative profiling of thiophene-containing reference materials
  • Analytical method development and validation support

Structural classification

SLU-PP-915 can be structurally classified as a boronic-acid-containing aromatic heterocyclic compound incorporating a thiophene ring, a fluorinated phenyl region and a carboxamide functionality.

Its molecular framework provides a distinctive combination of boron-containing, fluorinated, aromatic, heteroaromatic and amide structural features for comparative analytical workflows involving related reference materials.

Aromatic substitution pattern

The molecule contains a substituted phenylboronic acid region and a fluorophenyl-associated carboxamide region positioned on opposite sides of the central thiophene ring.

This substitution pattern creates multiple chemically distinguishable aromatic environments that may support structural verification using NMR, mass spectrometry and related analytical techniques.

Thiophene connectivity

The central thiophene ring connects the boronic-acid-containing phenyl region with the carboxamide-containing portion of the molecule.

This connectivity creates a conjugated heteroaromatic framework that may be evaluated using chromatographic, spectroscopic and mass-spectrometric analytical methods.

Ionisation behaviour

The boronic acid and amide functionalities may influence ionisation behaviour under different analytical conditions. Protonation, deprotonation and adduct formation can depend on solvent composition, mobile-phase additives and ionisation parameters.

Instrument settings and sample-preparation conditions should therefore be optimised according to validated laboratory procedures.

Elemental composition distribution

The molecular formula C17H13BFNO3S contains one boron atom, one fluorine atom, one nitrogen atom, three oxygen atoms and one sulfur atom distributed across the boronic acid, aromatic, thiophene and amide structural regions.

The theoretical elemental composition can support identity verification when combined with accurate-mass spectrometry and appropriate spectroscopic or elemental analysis.

Reference positioning in analytical workflows

As a chemical reference material, SLU-PP-915 may be used for qualitative structural comparison, method development and analytical identity verification in laboratories examining boronic acid derivatives, fluorinated aromatic compounds, thiophene-containing molecules or structurally related reference materials.

Analytical reproducibility depends on consistent sample preparation, validated instrument parameters, suitable reference documentation and controlled storage conditions.

Material consistency and traceability

Each unit is supplied in sealed laboratory packaging designed to support material integrity during storage and transport. Batch identification labelling supports traceability and internal documentation within controlled research environments.

Packaging should remain closed when the material is not in use and should be protected from moisture, excessive heat and direct light.

Handling and storage conditions

  • Storage: Store according to the conditions stated in the accompanying product documentation.
  • Handling: Handle according to standard laboratory safety procedures and the accompanying safety documentation.
  • Personal protection: Use appropriate laboratory gloves, protective clothing and eye protection.
  • Moisture protection: Minimise unnecessary exposure to air and humidity.
  • Long-term storage: Follow the conditions stated in the product documentation and applicable laboratory procedures.

 

Frequently asked technical questions

What is the CAS number of SLU-PP-915?
The CAS number is 2285432-92-8.

What is the PubChem CID of SLU-PP-915?
The PubChem compound identifier is 142532359.

What is the molecular formula of SLU-PP-915?
The molecular formula is C17H13BFNO3S.

What is the molecular weight of SLU-PP-915?
The molecular weight is approximately 341.2 g/mol.

Does SLU-PP-915 contain boron?
Yes. The molecular structure contains one boron atom within its boronic acid functionality.

Does SLU-PP-915 contain fluorine?
Yes. The molecular structure contains one fluorine atom within the fluorophenyl region.

Does SLU-PP-915 contain sulfur?
Yes. The molecular structure contains one sulfur atom within its thiophene ring.

What structural class does SLU-PP-915 belong to?
SLU-PP-915 is a boronic-acid-containing aromatic heterocyclic compound incorporating thiophene, fluorophenyl and carboxamide structural regions.

In which form is SLU-PP-915 supplied?
It is supplied as a laboratory solid in sealed packaging.

Is this product intended for human or animal use?
No. This material is supplied exclusively as a laboratory reference compound.

Disclaimer:
This product is supplied exclusively as a chemical reference material for laboratory and analytical purposes. Not for human or animal consumption. Not intended for food, supplement, cosmetic, medical, diagnostic or therapeutic use.

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Specifications

Intended use: Laboratory research and analytical reference purposes only
Application area: Analytical chemistry, reference comparison and method development
End user: Professional users in controlled research environments
Regulatory classification: Chemical reference material
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