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4,4'-Azoxydiphenol

CAT: 1596-AR-P31062-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P31062-01Size:10 Units
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CAS Number
15596-57-3
Synonyms
(Z) -1,2-Bis (4-hydroxyphenyl) diazene 1-oxide
Molecular Formula
C12H10N2O3
Molecular Weight
230.22
API Name
Phenacetin

Chemical Information

4,4'-Dihydroxyazoxybenzene
CAS Number15596-57-3
PubChem CID135404235
IUPAC Name(4-hydroxyphenyl)-(4-hydroxyphenyl)imino-oxidoazanium
Molecular FormulaC12H10N2O3
Molecular Weight230.22
XLogP2.4
Topological Polar Surface Area81.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity267
SMILES
C1=CC(=CC=C1N=[N+](C2=CC=C(C=C2)O)[O-])O
InChI
InChI=1S/C12H10N2O3/c15-11-5-1-9(2-6-11)13-14(17)10-3-7-12(16)8-4-10/h1-8,15-16H
InChIKey
VCVDNSCCCADAHZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,4'-Dihydroxyazoxybenzene
CAS: 15596-57-3
CID: 135404235
Formula: C12H10N2O3
MW: 230.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight230.22
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass230.06914219
Monoisotopic Mass230.06914219
Topological Polar Surface Area81.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity267
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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