3-Chloro-5-(trifluoromethyl)benzoic acid
Properties
- Molecular formula
- C8H4ClF3O2
- Molar mass
- 224.56 g/mol
- Exact mass
- 223.9852 Da
- logP
- 3.06Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
53985-49-2SMILES
C1=C(C=C(C=C1C(F)(F)F)Cl)C(=O)OInChIKey
IDLOGBMWOUINGG-UHFFFAOYSA-NInChI
InChI=1S/C8H4ClF3O2/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H,13,14)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-Chloro-5-(trifluoromethyl)benzoic acid
Similar compounds
3,5-Bis(trifluoromethyl)benzoic acid725-89-374 % similar
3,5-Dichlorobenzoic acid51-36-565 % similar
3-Fluoro-5-(trifluoromethyl)benzoic acid161622-05-564 % similar
3-Bromo-5-(trifluoromethyl)benzoic acid328-67-664 % similar
3-Hydroxy-5-(trifluoromethyl)benzoic acid328-69-864 % similar
1-[3-Chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone1125812-58-962 % similar
3-Amino-5-(trifluoromethyl)benzoic acid328-68-762 % similar
3-(Trifluoromethyl)benzoic acid454-92-261 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds
Same formula
2,4,5-Trifluoro-3-methoxybenzoyl chloride112811-66-2
4-Chloro-2-(trifluoromethyl)benzoic acid142994-09-0
2-(Trifluoromethoxy)benzoyl chloride162046-61-9
4-Chloro-3-(trifluoromethyl)benzoic acid1737-36-6
2-Chloro-4-trifluoromethylbenzoic acid23228-45-7
2-Chloro-6-(trifluoromethyl)be2376-00-3
4-Trifluoromethoxybenzoyl chloride36823-88-8
2-Chloro-3-(trifluoromethyl)benzoic acid39226-97-6