2-(4-Chlorophenyl)ethylamine

C₈H₁₀ClNCAS 156-41-2155.63 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₈H₁₀ClN
Molar mass: 155.63 g/mol
Exact mass: 155.0502 Da
Boiling point: 129–135 °C (at 24 Torr)
logP: 1.84Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation97.7% of notifiers
H319 Causes serious eye irritation95.3% of notifiers
H335 May cause respiratory irritation95.3% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

156-41-2

SMILES

NCCc1ccc(Cl)cc1

InChIKey

SRXFXCKTIGELTI-UHFFFAOYSA-N

InChI

InChI=1S/C8H10ClN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2

Weigh it out

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

Names and synonyms

15 names · show all

Benzeneethanamine, 4-chloro-
Phenethylamine, p-chloro-
4-Chlorobenzeneethanamine
p-Chloro-β-phenylethylamine
4-Chloro-β-phenylethylamine
p-Chlorophenethylamine
2-(p-Chlorophenyl)ethylamine
4-Chlorophenethylamine
4-Chloro-β-phenethylamine
[(4-Chlorophenyl)ethyl]amine
1-Amino-2-(p-chlorophenyl)ethane
2-(p-Chlorophenyl)-1-ethylamine
p-Chlorophenylethylamine
2-(4-Chlorophenyl)ethanamine
2-(4-Chlorophenyl)ethan-1-amine

Work with 2-(4-Chlorophenyl)ethylamine

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-Chlorobenzylamine104-86-961 % similar 3,4-Dichlorophenethylamine21581-45-356 % similar 2-(4-Aminophenyl)ethylamine13472-00-954 % similar Benzeneethanamine64-04-052 % similar 4-Fluorophenethylamine1583-88-652 % similar 4-Chlorobenzeneethanol1875-88-352 % similar 4-Methylphenethylamine3261-62-952 % similar Tyramine51-67-252 % similar

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

Same formula

4-Chloro-N-methylbenzenemethanamine104-11-0 2-(3-Chlorophenyl)ethylamine13078-79-0 2-(2-Chlorophenyl)ethylamine13078-80-3 4-Chloro-N-ethylbenzenamine13519-75-0 4-Chloro-2,6-dimethylaniline24596-18-7 3-Chloro-2,6-dimethylaniline26829-77-6 (+)-1-(4-Chlorophenyl)ethylamine27298-99-3 (-)-1-(4-Chlorophenyl)ethylamine4187-56-8

Elsewhere

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