chempirical

3,3′-Dichlorobenzidine dihydrochloride

C12H12Cl4N2CAS 612-83-9326.04 g/mol

Open in Covalent MOL file
HClHClH2NNH2ClCl
Aryl halidePrimary amine

Properties

Molecular formula
C12H12Cl4N2
Molar mass
326.04 g/mol
Exact mass
323.9755 Da
logP
4.67Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
612-83-9
SMILES
Cl.Cl.Nc1ccc(-c2ccc(N)c(Cl)c2)cc1Cl
InChIKey
BXAONUZFBUNTQR-UHFFFAOYSA-N
InChI
InChI=1S/C12H10Cl2N2.2ClH/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8;;/h1-6H,15-16H2;2*1H

Weigh it out

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

Names and synonyms

6 names
  • [1,1′-Biphenyl]-4,4′-diamine, 3,3′-dichloro-, hydrochloride (1:2)
  • Benzidine, 3,3′-dichloro-, dihydrochloride
  • [1,1′-Biphenyl]-4,4′-diamine, 3,3′-dichloro-, dihydrochloride
  • 3,3′-Dichloro-4,4′-diaminobiphenyl dihydrochloride
  • 3,3′-Dichloro[1,1′-biphenyl]-4,4′-diamine dihydrochloride
  • Dichlodine H

Work with 3,3′-Dichlorobenzidine dihydrochloride

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

3,3'-Dichlorobenzidine91-94-186 % similar 4-Amino-3-chlorophenol hydrochloride52671-64-462 % similar o-Chloroaniline hydrochloride137-04-262 % similar 3,3′-Diaminobenzidine tetrahydrochloride7411-49-660 % similar 2,4-Dichloroaniline554-00-756 % similar 2-Chloro-P-phenylenediamine615-66-756 % similar 2-Chloro-4-methylaniline615-65-654 % similar [1,1′-Biphenyl]-3,3′,4,4′-tetramine hydrochloride hydrate (1:4:?)868272-85-954 % similar

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

Elsewhere

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