4-Chloro-1,2-phenylenediamine

C6H7ClN2CAS 95-83-0142.59 g/mol

Open in Covalent MOL file
H2NClH2N
Aryl halidePrimary amine

Properties

Molecular formula
C6H7ClN2
Molar mass
142.59 g/mol
Exact mass
142.0298 Da
Melting point
76 °C
Boiling point
229.3 °C
Water solubility
< 1 g/L (18.9 °C)
logP
1.50Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)Health Hazard (GHS08)

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
95-83-0
SMILES
Nc1ccc(Cl)cc1N
InChIKey
BXIXXXYDDJVHDL-UHFFFAOYSA-N
InChI
InChI=1S/C6H7ClN2/c7-4-1-2-5(8)6(9)3-4/h1-3H,8-9H2

Weigh it out

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

Names and synonyms

22 names · show all
  • 1,2-Benzenediamine, 4-chloro-
  • o-Phenylenediamine, 4-chloro-
  • 4-Chloro-1,2-benzenediamine
  • C.I. 76015
  • 4-Chloro-1,2-diaminobenzene
  • Ursol olive 6G
  • 1,2-Diamino-4-chlorobenzene
  • 4-Chloro-o-phenylenediamine
  • 3-Chloro-1,6-phenylenediamine
  • 2-Amino-4-chloroaniline
  • 3,4-Diamino-1-chlorobenzene
  • 3,4-Diaminochlorobenzene
  • 4-Chloro-2-aminoaniline
  • 2-Amino-5-chloroaniline
  • p-Chloro-o-phenylenediamine
  • 2-Amino-4-chlorobenzenamine
  • 5-Chloro-1,2-phenylenediamine
  • NSC 6157
  • 4-Chlorophenyldiamine
  • 4-Chlorobenzen-1,2-diamine
  • 4-Chlorophenylenediamine
  • 5-Chlorobenzene-1,2-diamine

Work with 4-Chloro-1,2-phenylenediamine

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

2,4-Dichloroaniline554-00-765 % similar 2,5-Dichloroaniline95-82-965 % similar 4-Chloro-o-toluidine95-69-263 % similar 2-Amino-4-chlorothiophenol1004-00-860 % similar 5-Chloro-2-fluoroaniline2106-05-060 % similar 2-Amino-5-chlorophenol28443-50-760 % similar 4-Chloro-2-fluoroaniline57946-56-260 % similar 4-Chloro-2-iodoaniline63069-48-760 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4-Chlorophenyl)hydrazine1073-69-4 2-Chloro-5-ethylpyrimidine111196-81-7 3-Amino-2-chloro-4-methylpyridine133627-45-9 (2-Chloropyridin-4-yl)methanamine144900-57-2 3-Amino-6-chloro-2-picoline164666-68-6 (4-Chloropyridin-2-yl)methanamine180748-30-5 (2-Chloropyridin-3-yl)methanamine205744-14-5 2-Amino-5-chloro-3-methylpyridine20712-16-7

Elsewhere

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