2-Chloro-N,N-dimethylbenzenamine

C8H10ClNCAS 698-01-1155.62 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
Density
1.11 g/mL
Melting point
145 °C
Boiling point
205 °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 the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number
698-01-1
SMILES
CN(C)c1ccccc1Cl
InChIKey
QDCPXCIPVQJVDD-UHFFFAOYSA-N
InChI
InChI=1S/C8H10ClN/c1-10(2)8-6-4-3-5-7(8)9/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

4 names
  • Benzenamine, 2-chloro-N,N-dimethyl-
  • Aniline, o-chloro-N,N-dimethyl-
  • o-Chloro-N,N-dimethylaniline
  • 2-Chloro-N,N-dimethylaniline

Work with 2-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

N,N-Dimethyl-1-naphthylamine86-56-652 % similar 1,8-Bis(dimethylamino)naphthalene20734-58-150 % similar Dimethyl-o-toluidine609-72-350 % similar 2-Bromo-N,N-dimethylbenzenamine698-00-050 % similar 1,2-Dichlorobenzene95-50-148 % similar 3-Chloro-4-(dimethylamino)benzenediazonium hexafluorophosphate68400-43-146 % similar Dimethylaniline121-69-746 % similar 1-(2-Chlorophenyl)piperazine39512-50-045 % 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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