Cas no 1262007-12-4 (3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid)
3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid is a specialized aromatic carboxylic acid featuring both dichlorophenyl and trifluoromethyl substituents, which contribute to its unique electronic and steric properties. The presence of electron-withdrawing groups enhances its reactivity in organic synthesis, particularly in the formation of esters, amides, or other derivatives. This compound is valued for its potential as an intermediate in pharmaceutical and agrochemical applications, where its structural motifs may confer bioactivity or metabolic stability. Its high purity and well-defined molecular structure make it suitable for research and development in medicinal chemistry. The compound’s stability under standard conditions further ensures reliable handling and storage.
1262007-12-4 structure
Product Name:3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid
CAS No:1262007-12-4
MF:C14H7Cl2F3O2
MW:335.105392694473
MDL:MFCD18321832
CID:2621622
PubChem ID:53227667
Update Time:2025-06-07
3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- DTXSID50691200
- 3-(2,3-DICHLOROPHENYL)-5-TRIFLUOROMETHYLBENZOIC ACID
- 2',3'-Dichloro-5-(trifluoromethyl)[1,1'-biphenyl]-3-carboxylic acid
- 3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid, 95%
- 1262007-12-4
- MFCD18321832
- 3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid
-
- MDL: MFCD18321832
- Inchi: 1S/C14H7Cl2F3O2/c15-11-3-1-2-10(12(11)16)7-4-8(13(20)21)6-9(5-7)14(17,18)19/h1-6H,(H,20,21)
- InChI Key: AUWCOWPBSWXHAE-UHFFFAOYSA-N
- SMILES: ClC1C(=CC=CC=1C1=CC(C(=O)O)=CC(C(F)(F)F)=C1)Cl
Computed Properties
- Exact Mass: 333.9775193Da
- Monoisotopic Mass: 333.9775193Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 389
- 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: 5.3
- Topological Polar Surface Area: 37.3?2
3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB329085-5 g |
3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid, 95%; . |
1262007-12-4 | 95% | 5g |
€1159.00 | 2023-06-21 | |
| abcr | AB329085-5g |
3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid, 95%; . |
1262007-12-4 | 95% | 5g |
€1159.00 | 2025-04-21 |
3-(2,3-Dichlorophenyl)-5-trifluoromethylbenzoic acid Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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