4-Chloro-N-methylbenzenamine
Properties
- Molecular formula
- C7H8ClN
- Molar mass
- 141.60 g/mol
- Exact mass
- 141.0345 Da
- Boiling point
- 240 °C
- logP
- 2.38Crippen estimate
- Polar surface area
- 12.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H226 Flammable liquid and vapor88.9% of notifiers
- H302 Harmful if swallowed11.1% of notifiers
- H312 Harmful in contact with skin11.1% of notifiers
- H315 Causes skin irritation13.3% of notifiers
- H318 Causes serious eye damage86.7% of notifiers
- H319 Causes serious eye irritation13.3% of notifiers
- H332 Harmful if inhaled11.1% of notifiers
- H335 May cause respiratory irritation88.9% of notifiers
- H412 Harmful to aquatic life with long lasting effects86.7% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
932-96-7SMILES
CNc1ccc(Cl)cc1InChIKey
XCEYKKJMLOFDSS-UHFFFAOYSA-NInChI
InChI=1S/C7H8ClN/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzenamine, 4-chloro-N-methyl-
- Aniline, p-chloro-N-methyl-
- N-Methyl-4-chloroaniline
- p-Chloro-N-methylaniline
- 4-Chloro-N-methylaniline
- N-Methyl-p-chloroaniline
- p-(Methylamino)chlorobenzene
- N-(4-Chlorophenyl)methylamine
- N-(4-Chlorophenyl)-N-methylamine
Work with 4-Chloro-N-methylbenzenamine
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
(4-Chlorophenyl)hydrazine1073-69-452 % similar
N-Methyl-p-toluidine623-08-552 % similar
N-Methylaniline100-61-850 % similar
1,4-Dichlorobenzene106-46-750 % similar
4-Chloro-N-ethylbenzenamine13519-75-050 % similar
N-Methyl-p-aminophenol150-75-450 % similar
3,4-Dichloro-N-methylaniline40750-59-250 % similar
4-Fluoro-N-methylaniline459-59-650 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.