chempirical

(4-Chloro-2-fluorobenzyl)amine hydrochloride

C7H8Cl2FNCAS 202982-63-6196.05 g/mol

Open in Covalent MOL file
HClH2NClF
Aryl halidePrimary amine

Properties

Molecular formula
C7H8Cl2FN
Molar mass
196.05 g/mol
Exact mass
195.0018 Da
logP
2.36Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
202982-63-6
SMILES
Cl.NCc1ccc(Cl)cc1F
InChIKey
DFRJZBWKVAXYRV-UHFFFAOYSA-N
InChI
InChI=1S/C7H7ClFN.ClH/c8-6-2-1-5(4-10)7(9)3-6;/h1-3H,4,10H2;1H

Weigh it out

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

Names and synonyms

3 names
  • Benzenemethanamine, 4-chloro-2-fluoro-, hydrochloride (1:1)
  • Benzenemethanamine, 4-chloro-2-fluoro-, hydrochloride
  • (4-Chloro-2-fluorophenyl)methanamine hydrochloride

Work with (4-Chloro-2-fluorobenzyl)amine hydrochloride

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

4-Bromo-2-fluorobenzylamine hydrochloride147181-08-660 % similar 4-Chloro-2-fluorobenzenemethanol56456-49-656 % similar 4-Chloro-2-fluorobenzyl bromide71916-82-056 % similar 2,4-Difluorobenzylamine72235-52-055 % similar 2,4-Dichlorobenzenemethanamine95-00-155 % similar 4-Bromo-2-fluorobenzenemethanamine112734-22-251 % similar 4-Chloro-2-fluorobenzeneacetonitrile75279-53-751 % similar 2,5-Dichlorobenzylamine10541-69-250 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook