chempirical

4-Chloro-N-ethylbenzenamine

C8H10ClNCAS 13519-75-0155.63 g/mol

Open in Covalent MOL file
HNCl
Aryl halideSecondary amine

Properties

Molecular formula
C8H10ClN
Molar mass
155.63 g/mol
Exact mass
155.0502 Da
Boiling point
247–250 °C
logP
2.77Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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
13519-75-0
SMILES
CCNc1ccc(Cl)cc1
InChIKey
KLWDPIXDUVYHMS-UHFFFAOYSA-N
InChI
InChI=1S/C8H10ClN/c1-2-10-8-5-3-7(9)4-6-8/h3-6,10H,2H2,1H3

Weigh it out

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

Names and synonyms

8 names
  • Benzenamine, 4-chloro-N-ethyl-
  • Aniline, p-chloro-N-ethyl-
  • p-Chloro-N-ethylaniline
  • N-Ethyl-p-chloroaniline
  • N-Ethyl-4-chloroaniline
  • 4-Chloro-N-ethylaniline
  • N-(4-Chlorophenyl)-N-ethylamine
  • N-(4-Chlorophenyl)ethylamine

Reactions

Work with 4-Chloro-N-ethylbenzenamine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Ethyl-4-methylaniline622-57-158 % similar N-Ethylaniline103-69-556 % similar 4-Chloro-N1-ethyl-1,2-benzenediamine62476-15-753 % similar 4-Chloro-N-methylbenzenamine932-96-750 % similar (4-Chlorophenyl)hydrazine1073-69-446 % similar N-Ethyl-4-(trifluoromethoxy)aniline175278-20-345 % similar N-Ethyl-m-toluidine102-27-245 % similar 1-Chloro-4-ethylbenzene622-98-044 % 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 2-(4-Chlorophenyl)ethylamine156-41-2 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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