4-(Trifluoromethyl)aniline
Properties
- Molecular formula
- C7H6F3N
- Molar mass
- 161.13 g/mol
- Exact mass
- 161.0452 Da
- Density
- 1.283 g/mL (at 27 °C)
- Melting point
- 38 °C
- Boiling point
- 117.5 °C
- logP
- 2.29Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Identifiers
CAS number
455-14-1SMILES
Nc1ccc(C(F)(F)F)cc1InChIKey
ODGIMMLDVSWADK-UHFFFAOYSA-NInChI
InChI=1S/C7H6F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H,11H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
13 names · show all
- Benzenamine, 4-(trifluoromethyl)-
- p-Toluidine, α,α,α-trifluoro-
- 4-(Trifluoromethyl)benzenamine
- p-Aminobenzotrifluoride
- p-(Trifluoromethyl)aniline
- α,α,α-Trifluoro-p-toluidine
- p-Amino-α,α,α-trifluorotoluene
- 4-Aminobenzotrifluoride
- 4-Amino-α,α,α-benzotrifluoride
- (4-(Trifluoromethyl)phenyl)amine
- NSC 10337
- p-Trifluoromethylphenylamine
- 1-Amino-4-(trifluoromethyl)benzene
Work with 4-(Trifluoromethyl)aniline
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
4-(Trifluoromethyl)aniline hydrochloride90774-69-986 % similar
1,4-Bis(trifluoromethyl)benzene433-19-267 % similar
4,4′-[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis[benzenamine]1095-78-958 % similar
4,4′,4′′,4′′′-Methanetetrayltetrakis[benzenamine]60532-63-057 % similar
3,5-Bis(trifluoromethyl)benzenamine328-74-557 % similar
3,5-Diaminobenzotrifluoride368-53-657 % similar
4-Fluorobenzotrifluoride402-44-852 % similar
4-Trifluoromethylphenylhydrazine368-90-152 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds