3-Fluoro-5-(trifluoromethyl)benzenemethanamine

C₈H₇F₄NCAS 150517-77-4193.14 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₈H₇F₄N
Molar mass: 193.14 g/mol
Exact mass: 193.0515 Da
logP: 2.30Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

150517-77-4

SMILES

NCc1cc(F)cc(C(F)(F)F)c1

InChIKey

ADHUUMWSWNPEMZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H7F4N/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-3H,4,13H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

Benzenemethanamine, 3-fluoro-5-(trifluoromethyl)-
3-Fluoro-5-(trifluoromethyl)benzylamine
[3-Fluoro-5-(trifluoromethyl)phenyl]methanamine

Work with 3-Fluoro-5-(trifluoromethyl)benzenemethanamine

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3,5-Bis(trifluoromethyl)benzylamine85068-29-774 % similar 3,5-Difluorobenzylamine90390-27-563 % similar 3-(Trifluoromethyl)benzylamine2740-83-255 % similar 3-Fluoro-5-trifluoromethylaniline454-67-153 % similar 4-(Trifluoromethyl)benzylamine3300-51-452 % similar 3-Bromo-5-fluorobenzotrifluoride130723-13-648 % similar 3-Fluorobenzylamine100-82-347 % similar 3-Fluorobenzotrifluoride401-80-944 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Fluoro-2-(trifluoromethyl)benzenemethanamine231291-14-8

Elsewhere

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