4-Chloro-3-methylaniline
Properties
- Molecular formula
- C7H8ClN
- Molar mass
- 141.60 g/mol
- Exact mass
- 141.0345 Da
- Melting point
- 83.5 °C
- Boiling point
- 241 °C
- logP
- 2.23Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Warning
- H302 Harmful if swallowed14.6% of notifiers
- H312 Harmful in contact with skin14.6% of notifiers
- H315 Causes skin irritation95.8% of notifiers
- H319 Causes serious eye irritation95.8% of notifiers
- H332 Harmful if inhaled14.6% of notifiers
- H335 May cause respiratory irritation83.3% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure12.5% of notifiers
Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
7149-75-9SMILES
Cc1cc(N)ccc1ClInChIKey
HIHCTGNZNHSZPP-UHFFFAOYSA-NInChI
InChI=1S/C7H8ClN/c1-5-4-6(9)2-3-7(5)8/h2-4H,9H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzenamine, 4-chloro-3-methyl-
- m-Toluidine, 4-chloro-
- 4-Chloro-3-methylbenzenamine
- 5-Amino-2-chlorotoluene
- 3-Methyl-4-chloroaniline
- 4-Chloro-m-toluidine
- 2-Chloro-5-aminotoluene
- (4-Chloro-3-methylphenyl)amine
- NSC 72329
Work with 4-Chloro-3-methylaniline
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
3-Chloro-4-methylaniline95-74-969 % similar
3,4-Xylidine95-64-760 % similar
3,4-Dichloroaniline95-76-160 % similar
2,2′-Dimethylbenzidine84-67-358 % similar
4-Chloro-3-methoxyaniline13726-14-257 % similar
2,5-Dichlorotoluene19398-61-956 % similar
4-Chloro-m-phenylenediamine5131-60-256 % similar
4-Chloro-M-xylene95-66-956 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.