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119176-66-8 | Phenol, 4,4'-azoxybis[3-methyl- (9CI)
CAS No: 119176-66-8 Catalog No: AG000IAM MDL No:
Product Description
Catalog Number:
AG000IAM
Chemical Name:
Phenol, 4,4'-azoxybis[3-methyl- (9CI)
CAS Number:
119176-66-8
Molecular Formula:
C14H14N2O3
Molecular Weight:
258.2726
IUPAC Name:
(4-hydroxy-2-methylphenyl)-(4-hydroxy-2-methylphenyl)imino-oxidoazanium
InChI:
InChI=1S/C14H14N2O3/c1-9-7-11(17)3-5-13(9)15-16(19)14-6-4-12(18)8-10(14)2/h3-8,17-18H,1-2H3
InChI Key:
DGMQEEYHXMMMOX-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)C)N=[N+](c1ccc(cc1C)O)[O-]
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.277g/mol
Monoisotopic Mass:
258.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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