chempirical

4-Chloro-2-methylaniline hydrochloride

C7H9Cl2NCAS 3165-93-3178.06 g/mol

Open in Covalent MOL file
ClH2NHCl
Aryl halidePrimary amine

Properties

Molecular formula
C7H9Cl2N
Molar mass
178.06 g/mol
Exact mass
177.0112 Da
logP
2.65Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
3165-93-3
SMILES
Cc1cc(Cl)ccc1N.Cl
InChIKey
VKYZDCTWJGBFDW-UHFFFAOYSA-N
InChI
InChI=1S/C7H8ClN.ClH/c1-5-4-6(8)2-3-7(5)9;/h2-4H,9H2,1H3;1H

Weigh it out

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

Names and synonyms

12 names
  • Benzenamine, 4-chloro-2-methyl-, hydrochloride (1:1)
  • o-Toluidine, 4-chloro-, hydrochloride
  • Benzenamine, 4-chloro-2-methyl-, hydrochloride
  • C.I. 37085
  • Azogene fast red TR
  • Devol red K
  • Devol red TR
  • Neutrosel red TRVA
  • 4-Chloro-o-toluidine hydrochloride
  • 4-Chloro-2-methylbenzenamine hydrochloride
  • p-Chloro-o-toluidine hydrochloride
  • 2-Methyl-4-chloroaniline hydrochloride

Work with 4-Chloro-2-methylaniline hydrochloride

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chloro-O-toluidine95-69-288 % similar 3,3′-Dimethylbenzidine dihydrochloride612-82-864 % similar 5-Chloro-2-methylaniline95-79-464 % similar 2,4-Dimethylaniline hydrochloride21436-96-462 % similar 2-Methylbenzene-1,4-diamine dihydrochloride615-45-262 % similar (4-Chloro-2-methylphenyl)hydrazine hydrochloride19690-59-659 % similar 4-Chloro-1,2-dimethylbenzene615-60-156 % similar 4-Chloro-1,2-phenylenediamine95-83-056 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-(Chloromethyl)-6-methylpyridine hydrochloride3099-30-7 5-Chloro-o-toluidine hydrochloride6259-42-3

Elsewhere

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