chempirical

3,3′-Dimethoxybenzidine dihydrochloride

C14H18Cl2N2O2CAS 20325-40-0317.21 g/mol

Open in Covalent MOL file
ONH2OH2NHClHCl
EtherPrimary amine

Properties

Molecular formula
C14H18Cl2N2O2
Molar mass
317.21 g/mol
Exact mass
316.0745 Da
logP
3.38Crippen estimate
Polar surface area
70.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Identifiers

CAS number
20325-40-0
SMILES
COc1cc(-c2ccc(N)c(OC)c2)ccc1N.Cl.Cl
InChIKey
UXTIAFYTYOEQHV-UHFFFAOYSA-N
InChI
InChI=1S/C14H16N2O2.2ClH/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2;;/h3-8H,15-16H2,1-2H3;2*1H

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

Names and synonyms

5 names
  • [1,1′-Biphenyl]-4,4′-diamine, 3,3′-dimethoxy-, hydrochloride (1:2)
  • Benzidine, 3,3′-dimethoxy-, dihydrochloride
  • [1,1′-Biphenyl]-4,4′-diamine, 3,3′-dimethoxy-, dihydrochloride
  • C.I. Disperse Black 6 dihydrochloride
  • o-Dianisidine dihydrochloride

Work with 3,3′-Dimethoxybenzidine 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

O-Dianisidine119-90-488 % similar Fast red BB base134-29-259 % similar 2,4-Dimethoxyaniline2735-04-859 % similar 3,3′-Diaminobenzidine tetrahydrochloride7411-49-656 % similar 4-Bromo-2-methoxybenzenamine59557-91-455 % similar 4-Chloro-2-methoxybenzenamine93-50-555 % similar 3,3′-Dimethylbenzidine dihydrochloride612-82-853 % similar 2,4-Diaminoanisole dihydrochloride614-94-853 % similar

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

Elsewhere

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