3-Chloro-N,N-dimethylbenzenamine

C8H10ClNCAS 6848-13-1155.62 g/mol

Open in Covalent MOL file
NCl
Aryl halideTertiary amine

Properties

Molecular formula
C8H10ClN
Molar mass
155.62 g/mol
Exact mass
155.0502 Da
Boiling point
251–252 °C
logP
2.41Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P337+P317, P362+P364, P501

Identifiers

CAS number
6848-13-1
SMILES
CN(C)c1cccc(Cl)c1
InChIKey
CHHCCYVOJBBCIY-UHFFFAOYSA-N
InChI
InChI=1S/C8H10ClN/c1-10(2)8-5-3-4-7(9)6-8/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

9 names
  • Benzenamine, 3-chloro-N,N-dimethyl-
  • Aniline, m-chloro-N,N-dimethyl-
  • m-Chloro-N,N-dimethylaniline
  • 3-Chloro-N,N-dimethylaniline
  • N,N-Dimethyl-m-chloroaniline
  • N,N-Dimethyl-3-chloroaniline
  • 3-Dimethylamino-1-chlorobenzene
  • 1-Chloro-3-dimethylaminobenzene
  • 3-(N,N-Dimethylamino)-1-chlorobenzene

Work with 3-Chloro-N,N-dimethylbenzenamine

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

Dimethyl-m-toluidine121-72-258 % similar 3-Bromo-N,N-dimethylaniline16518-62-056 % similar 3-(Dimethylamino)phenol99-07-056 % similar 1,3-Dichlorobenzene541-73-152 % similar Dimethylaniline121-69-752 % similar 3-Methoxy-N,N-dimethylbenzenamine15799-79-852 % similar 3-(Dimethylamino)benzeneboronic acid178752-79-950 % similar 3-(Dimethylamino)benzenemethanol23501-93-150 % 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 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

Elsewhere

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