4-Trifluoromethylbenzoic acid sodium salt
Properties
- Molecular formula
- C8H4F3NaO2
- Molar mass
- 212.10 g/mol
- Exact mass
- 212.0061 Da
- logP
- 2.02Crippen 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.
Identifiers
CAS number
25832-58-0SMILES
[O-]C(=O)c1ccc(C(F)(F)F)cc1.[Na+]InChI
The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.
Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Benzoic acid, 4-(trifluoromethyl)-, sodium salt (1:1)
- p-Toluic acid, α,α,α-trifluoro-, sodium salt
- Benzoic acid, 4-(trifluoromethyl)-, sodium salt
- Sodium 4-(trifluoromethyl)benzoate
- Sodium α,α,α-trifluoro-p-toluate
Work with 4-Trifluoromethylbenzoic acid sodium salt
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Sodium p-fluorobenzoate499-90-159 % similar
Sodium benzoate532-32-155 % similar
Sodium p-hydroxybenzoate114-63-655 % similar
Sodium p-aminobenzoate555-06-655 % similar
4-(Trifluoromethyl)benzamide1891-90-353 % similar
4-(Trifluoromethyl)benzoyl fluoride368-94-552 % similar
4-Trifluoromethylbenzoic anhydride25753-16-650 % similar
4-(Trifluoromethyl)benzoyl chloride329-15-750 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.