Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥98%(HPLC) Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 15 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
A potent inhibitor of Cox-1 and Cox-2
| ALogP | 4.2 |
|---|
| Pubchem Sid | 504750670 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504750670 |
| Sourires canoniques | CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O |
| IUPAC Name | 2-(3-fluoro-4-phenylphenyl)propanoic acid |
| InChIKey | SYTBZMRGLBWNTM-UHFFFAOYSA-N |
| INCHI | 1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18) |
| Isomères SMILES | CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O |
| RTECS | DU8341000 |
| Poids moléculaire | 244.27 |
| Reaxy-Rn | 2054451 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2054451&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Classe | Benzene and substituted derivatives |
| Subclass | Biphenyls and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Biphenyls and derivatives |
| Alternative Parents | Phenylpropanoic acids Monocyclic monoterpenoids Aromatic monoterpenoids Fluorobenzenes Aryl fluorides Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Biphenyl - 2-phenylpropanoic-acid - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Fluorobenzene - Halobenzene - Aryl halide - Aryl fluoride - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond. |
| External Descriptors | fluorobiphenyl |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Article |
|---|---|---|---|
| Certificate of Analysis | Aug 08, 2026 | F134483 | |
| Certificate of Analysis | Aug 08, 2026 | F134483 | |
| Certificate of Analysis | Aug 08, 2026 | F134483 | |
| Certificate of Analysis | Aug 11, 2025 | F134483 | |
| Certificate of Analysis | Jul 09, 2025 | F134483 | |
| Certificate of Analysis | May 30, 2025 | F134483 | |
| Certificate of Analysis | Oct 21, 2024 | F134483 | |
| Certificate of Analysis | Jun 26, 2024 | F134483 | |
| Certificate of Analysis | Jun 26, 2024 | F134483 | |
| Certificate of Analysis | Jun 26, 2024 | F134483 | |
| Certificate of Analysis | Jun 26, 2024 | F134483 | |
| Certificate of Analysis | Feb 12, 2022 | F134483 | |
| Certificate of Analysis | Feb 12, 2022 | F134483 | |
| Certificate of Analysis | Feb 12, 2022 | F134483 | |
| Certificate of Analysis | Feb 12, 2022 | F134483 | |
| Certificate of Analysis | Feb 12, 2022 | F134483 |
| Solubilité | Soluble in DMSO (50 mg/ml), methanol (50 mg/ml), ethanol (~100 mg/ml), DMF (~100 mg/ml), and buffers of ionic strength ≥0.1 M and pH ≥7.4 (~5 mg/ml). Insoluble in water, Soluble in DMSO (50 mg/ml), methanol (50 mg/ml), ethanol (~100 mg/ml), DMF (~1 |
|---|---|
| Point de fusion (°C) | 113 °C |
| Poids moléculaire | 244.260 g/mol |
| XLogP3 | 4.200 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 244.09 Da |
| Monoisotopic Mass | 244.09 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 286.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.
View Moligand™ grade guide →