Cas no 1261824-88-7 (3-fluoro-4-[2-(trifluoromethyl)phenyl]benzoic Acid)
![3-fluoro-4-[2-(trifluoromethyl)phenyl]benzoic Acid structure](https://ossimg.kuujia.com/scimg/1262000/1261824-88-7x500.png)
1261824-88-7 structure
Product Name:3-fluoro-4-[2-(trifluoromethyl)phenyl]benzoic Acid
CAS No:1261824-88-7
MF:C14H8F4O2
MW:284.205738067627
CID:1222990
PubChem ID:53211749
Update Time:2025-04-20
3-fluoro-4-[2-(trifluoromethyl)phenyl]benzoic Acid Chemical and Physical Properties
Names and Identifiers
-
- 3-fluoro-4-[2-(trifluoromethyl)phenyl]benzoic Acid
- 2-Fluoro-2'-(trifluoromethyl)[1,1'-biphenyl]-4-carboxylic acid
- 3-Fluoro-4-(2-trifluoromethylphenyl)benzoic acid, 95%
- MFCD18321732
- 2-Fluoro-2'-(trifluoromethyl)-[1,1'-biphenyl]-4-carboxylic acid
- 1261824-88-7
- A1-68116
- AKOS012095469
- 3-FLUORO-4-(2-TRIFLUOROMETHYLPHENYL)BENZOIC ACID
- DTXSID90681448
-
- Inchi： 1S/C14H8F4O2/c15-12-7-8(13(19)20)5-6-10(12)9-3-1-2-4-11(9)14(16,17)18/h1-7H,(H,19,20)
- InChI Key： BCDCXWKPZVWVOQ-UHFFFAOYSA-N
- SMILES： FC1C=C(C(=O)O)C=CC=1C1C=CC=CC=1C(F)(F)F
Computed Properties
- Exact Mass: 284.04604214g/mol
- Monoisotopic Mass: 284.04604214g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 356
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.1
- Topological Polar Surface Area: 37.3?2
3-fluoro-4-[2-(trifluoromethyl)phenyl]benzoic Acid Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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