chempirical

2,5-Difluorobenzenemethanamine

C7H7F2NCAS 85118-06-5143.14 g/mol

Open in Covalent MOL file
H2NFF
Aryl halidePrimary amine

Properties

Molecular formula
C7H7F2N
Molar mass
143.14 g/mol
Exact mass
143.0547 Da
logP
1.42Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
85118-06-5
SMILES
NCc1cc(F)ccc1F
InChIKey
GDFBHCMFIUBEQT-UHFFFAOYSA-N
InChI
InChI=1S/C7H7F2N/c8-6-1-2-7(9)5(3-6)4-10/h1-3H,4,10H2

Weigh it out

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

Names and synonyms

4 names
  • Benzenemethanamine, 2,5-difluoro-
  • 2,5-Difluorobenzylamine
  • [(2,5-Difluorophenyl)methyl]amine
  • (2,5-Difluorophenyl)methanamine

Work with 2,5-Difluorobenzenemethanamine

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-Chloro-5-fluorobenzenemethanamine202522-23-460 % similar 5-Fluoro-2-methylbenzenemethanamine261951-69-360 % similar 2-Bromo-5-fluorobenzenemethanamine747392-34-360 % similar 2,5-Difluorobenzenemethanol75853-20-259 % similar 2,5-Difluorobenzyl bromide85117-99-359 % similar 5-Fluoro-2-(trifluoromethyl)benzenemethanamine231291-14-856 % similar (5-Bromo-2-fluorobenzyl)amine hydrochloride202865-69-855 % similar 2-Fluorobenzylamine89-99-654 % similar

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

Same formula

2,4-Difluoro-N-methylaniline138564-16-6 2,6-Difluorobenzylamine69385-30-4 2,4-Difluorobenzylamine72235-52-0 3,4-Difluorobenzylamine72235-53-1 3,5-Difluorobenzylamine90390-27-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook