2-Chloro-1,4-benzenediamine hydrochloride

C₆H₈Cl₂N₂CAS 62106-51-8179.04 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₈Cl₂N₂
Molar mass: 179.04 g/mol
Exact mass: 178.0065 Da
logP: 1.93Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

62106-51-8

SMILES

C1=CC(=C(C=C1N)Cl)N.Cl

InChIKey

DUARBEGXKPFDPX-UHFFFAOYSA-N

InChI

InChI=1S/C6H7ClN2.ClH/c7-5-3-4(8)1-2-6(5)9;/h1-3H,8-9H2;1H

Weigh it out

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

Work with 2-Chloro-1,4-benzenediamine 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Chloro-p-phenylenediamine615-66-7Free base C.I. Oxidation base 13A6219-71-2Salt 2-Chloro-1,4-diaminobenzene monosulfate61702-44-1Salt

Similar compounds

3,3′-Dichlorobenzidine dihydrochloride612-83-967 % similar 1,2,4-Triaminobenzene dihydrochloride615-47-462 % similar 4-Amino-3-chlorophenol hydrochloride52671-64-460 % similar o-Chloroaniline hydrochloride137-04-259 % similar 4-Chloro-m-phenylenediamine5131-60-259 % similar 3,4-Dichloroaniline95-76-158 % similar 3,3′-Dichlorobenzidine91-94-156 % similar 2,4-Dichloroaniline554-00-754 % similar

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

Same formula

p-Chlorophenylhydrazine monohydrochloride1073-70-7 3-Chlorophenylhydrazine hydrochloride2312-23-4 2-Chlorophenylhydrazine hydrochloride41052-75-9

Elsewhere

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