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trans-4,4'-Azodiphenol

CAT: 0572-TRC-A950000-2.5GSize: 2.5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-A950000-2.5GSize:2.5 g
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CAS Number
51437-66-2
Synonyms
trans-4,4'-Azodiphenol
Hazard Statement
No Data Available
Smiles
Oc1ccc(cc1)N=Nc2ccc(O)cc2
Molecular Formula
C12 H10 N2 O2
Molecular Weight
214.22
InChI
InChI=1S/C12H10N2O2/c15-11-5-1-9(2-6-11)13-14-10-3-7-12(16)8-4-10/h1-8,15-16H
Additionnal Information
IUPAC name: 4-[(E)-(4-hydroxyphenyl)diazenyl]phenol
Shipping Conditions
Room Temperature

Chemical Information

4,4'-Dihydroxyazobenzene

isolated from fungus Agaricus xanthodermus; structure given in first source

CAS Number51437-66-2
PubChem CID101245
IUPAC Name4-[(4-hydroxyphenyl)diazenyl]phenol
Molecular FormulaC12H10N2O2
Molecular Weight214.22
XLogP3.4
Topological Polar Surface Area65.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity205
SMILES
C1=CC(=CC=C1N=NC2=CC=C(C=C2)O)O
InChI
InChI=1S/C12H10N2O2/c15-11-5-1-9(2-6-11)13-14-10-3-7-12(16)8-4-10/h1-8,15-16H
InChIKey
WKODVHZBYIBMOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,4'-Dihydroxyazobenzene
CAS: 51437-66-2
CID: 101245
Formula: C12H10N2O2
MW: 214.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight214.22
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass214.074227566
Monoisotopic Mass214.074227566
Topological Polar Surface Area65.2 Ų
Heavy Atom Count16
Formal Charge0
Complexity205
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