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3,3'-Diaminobenzidine

CAT: 1266-JH564569Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
91-95-2

Chemical Information

3,3'-Diaminobenzidine

3,3'-diaminobenzidine is a member of the class of biphenyls that is benzidine in which one of the hydrogens ortho to each of the amino groups has been replaced by an amino group. It has a role as a histological dye. It is a member of biphenyls and a substituted aniline.

CAS Number91-95-2
PubChem CID7071
IUPAC Name4-(3,4-diaminophenyl)benzene-1,2-diamine
Molecular FormulaC12H14N4
Molecular Weight214.27
XLogP0.9
Topological Polar Surface Area104
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity209
SMILES
C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N
InChI
InChI=1S/C12H14N4/c13-9-3-1-7(5-11(9)15)8-2-4-10(14)12(16)6-8/h1-6H,13-16H2
InChIKey
HSTOKWSFWGCZMH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,3'-Diaminobenzidine
CAS: 91-95-2
CID: 7071
Formula: C12H14N4
MW: 214.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight214.27
XLogP30.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass214.121846464
Monoisotopic Mass214.121846464
Topological Polar Surface Area104 Ų
Heavy Atom Count16
Formal Charge0
Complexity209
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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sc-2165673,3′-Diaminobenzidine
426826-013,3'-Diaminobenzidine
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D1000-01-01DAB (3,3'-Diaminobenzidine)
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