Cas no 1261772-06-8 (2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid)
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid is a fluorinated aromatic carboxylic acid derivative characterized by its unique structural features, including a fluorine substituent and a trifluoromethylphenyl group. This compound is of interest in pharmaceutical and agrochemical research due to its potential as a building block for active ingredients. The presence of fluorine atoms enhances metabolic stability and bioavailability, making it valuable in drug discovery. Its benzoic acid moiety allows for further functionalization, enabling the synthesis of more complex molecules. The compound's well-defined structure and purity make it suitable for precise applications in medicinal chemistry and material science. Proper handling and storage are recommended due to its reactive carboxylic acid group.
1261772-06-8 structure
Product Name:2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid
CAS No:1261772-06-8
MF:C14H8F4O2
MW:284.205738067627
MDL:MFCD18321734
CID:1038953
PubChem ID:53211746
Update Time:2025-05-28
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 4-Fluoro-2'-(trifluoromethyl)-[1,1'-biphenyl]-3-carboxylic acid
- 2-FLUORO-5-(2-TRIFLUOROMETHYLPHENYL)BENZOIC ACID
- [1,1'-Biphenyl]-3-carboxylic acid, 4-fluoro-2'-(trifluoromethyl)-
- AKOS012098056
- CS-0209435
- 4-Fluoro-2'-(trifluoromethyl)-[1,1'-biphenyl]-3-carboxylicacid
- DTXSID10681445
- BS-20105
- 2-fluoro-5-[2-(trifluoromethyl)phenyl]benzoic acid
- 1261772-06-8
- MFCD18321734
- 4-Fluoro-2'-(trifluoromethyl)[1,1'-biphenyl]-3-carboxylic acid
- 2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid
-
- MDL: MFCD18321734
- Inchi: 1S/C14H8F4O2/c15-12-6-5-8(7-10(12)13(19)20)9-3-1-2-4-11(9)14(16,17)18/h1-7H,(H,19,20)
- InChI Key: WUSDOOIDUMQOLE-UHFFFAOYSA-N
- SMILES: FC(C1C=CC=CC=1C1C=CC(=C(C(=O)O)C=1)F)(F)F
Computed Properties
- Exact Mass: 284.04600
- Monoisotopic Mass: 284.04604214g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- 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
Experimental Properties
- PSA: 37.30000
- LogP: 4.20970
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid Security Information
- Signal Word:warning
- Hazard Statement: H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement: P264+P280+P305+P351+P338+P337+P313
- Safety Instruction: H303+H313+H333
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid Customs Data
- HS CODE:2916399090
- Customs Data:
China Customs Code:
2916399090Overview:
2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly
Summary:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F180818-1g |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid |
1261772-06-8 | 98% | 1g |
¥4502.90 | 2023-09-02 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F180818-5g |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid |
1261772-06-8 | 98% | 5g |
¥13154.90 | 2023-09-02 | |
| Alichem | A011009256-250mg |
4-Fluoro-2'-(trifluoromethyl)biphenyl-3-carboxylic acid |
1261772-06-8 | 97% | 250mg |
470.40 USD | 2021-07-05 | |
| Alichem | A011009256-500mg |
4-Fluoro-2'-(trifluoromethyl)biphenyl-3-carboxylic acid |
1261772-06-8 | 97% | 500mg |
847.60 USD | 2021-07-05 | |
| Alichem | A011009256-1g |
4-Fluoro-2'-(trifluoromethyl)biphenyl-3-carboxylic acid |
1261772-06-8 | 97% | 1g |
1,475.10 USD | 2021-07-05 | |
| TRC | F598900-100mg |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid |
1261772-06-8 | 100mg |
$64.00 | 2023-05-18 | ||
| TRC | F598900-250mg |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid |
1261772-06-8 | 250mg |
$75.00 | 2023-05-18 | ||
| TRC | F598900-500mg |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid |
1261772-06-8 | 500mg |
$87.00 | 2023-05-18 | ||
| TRC | F598900-1g |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid |
1261772-06-8 | 1g |
$98.00 | 2023-05-18 | ||
| Fluorochem | 218819-5g |
4-Fluoro-2'-(trifluoromethyl)-[1,1'-biphenyl]-3-carboxylic acid |
1261772-06-8 | 95% | 5g |
£225.00 | 2022-03-01 |
2-Fluoro-5-(2-trifluoromethylphenyl)benzoic acid Related Literature
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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