chempirical

3,5-Difluorobenzylamine

C7H7F2NCAS 90390-27-5143.14 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
Melting point
261–262 °C
logP
1.42Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
90390-27-5
SMILES
NCc1cc(F)cc(F)c1
InChIKey
VJNGGOMRUHYAMC-UHFFFAOYSA-N
InChI
InChI=1S/C7H7F2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3H,4,10H2

Weigh it out

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

Names and synonyms

5 names
  • Benzenemethanamine, 3,5-difluoro-
  • 3,5-Difluorobenzenemethanamine
  • [(3,5-Difluorophenyl)methyl]amine
  • (3,5-Difluorophenyl)methanamine
  • 1-(3,5-Difluorophenyl)methanamine

Work with 3,5-Difluorobenzylamine

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-Fluoro-5-(trifluoromethyl)benzenemethanamine150517-77-463 % similar 3-Fluorobenzylamine100-82-363 % similar 4-Fluorobenzylamine140-75-057 % similar 3,4,5-Trifluorobenzenemethanamine235088-69-452 % similar 1-Ethyl-3,5-difluorobenzene117358-52-850 % similar 1,3,5-Trifluorobenzene372-38-350 % similar 3,5-Difluorophenylacetonitrile122376-76-544 % similar 3,5-Bis(trifluoromethyl)benzylamine85068-29-744 % 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 2,5-Difluorobenzenemethanamine85118-06-5

Elsewhere

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