2-Fluoro-3-(trifluoromethyl)benzylamine

C₈H₇F₄NCAS 239135-49-0193.14 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

239135-49-0

SMILES

C1=CC(=C(C(=C1)C(F)(F)F)F)CN

InChIKey

PQUYJDPJHOSOTN-UHFFFAOYSA-N

InChI

InChI=1S/C8H7F4N/c9-7-5(4-13)2-1-3-6(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

1 names

2-Fluoro-3-trifluoromethylbenzylamine

Work with 2-Fluoro-3-(trifluoromethyl)benzylamine

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

2-(Trifluoromethyl)benzenemethanamine3048-01-967 % similar 1-(Bromomethyl)-2-fluoro-3-(trifluoromethyl)benzene184970-25-064 % similar 2-Fluoro-3-(trifluoromethyl)benzyl alcohol207981-45-164 % similar 2-Chloro-3-(trifluoromethyl)benzylamine39226-96-564 % similar 2-Fluoro-3-(trifluoromethyl)benzeneacetonitrile239087-10-658 % similar 2-Fluoro-3-(trifluoromethyl)aniline123973-25-155 % similar 3-Chloro-2-fluorobenzenemethanamine72235-55-355 % similar 1,2-Difluoro-3-(trifluoromethyl)benzene64248-59-553 % similar

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

Same formula

3-Fluoro-5-(trifluoromethyl)benzenemethanamine150517-77-4 2-Fluoro-5-(trifluoromethyl)benzylamine199296-61-2 (4-Fluoro-2-(trifluoromethyl)phenyl)methanamine202522-22-3 5-Fluoro-2-(trifluoromethyl)benzenemethanamine231291-14-8 3-Fluoro-4-(trifluoromethyl)benzylamine235106-09-9 2-Fluoro-4-(trifluoromethyl)benzylamine239087-05-9 2-Fluoro-6-(trifluoromethyl)benzylamine239087-06-0

Elsewhere

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