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86317-70-6 | Diazene, (4-methylphenyl)[3-[(4-methylphenyl)azo]phenyl]-, 2-oxide
CAS No: 86317-70-6 Catalog No: AG004JET MDL No:
Product Description
Catalog Number:
AG004JET
Chemical Name:
Diazene, (4-methylphenyl)[3-[(4-methylphenyl)azo]phenyl]-, 2-oxide
CAS Number:
86317-70-6
Molecular Formula:
C20H18N4O
Molecular Weight:
330.3831
IUPAC Name:
(4-methylphenyl)-[3-[(4-methylphenyl)diazenyl]phenyl]imino-oxidoazanium
InChI:
InChI=1S/C20H18N4O/c1-15-6-10-17(11-7-15)21-22-18-4-3-5-19(14-18)23-24(25)20-12-8-16(2)9-13-20/h3-14H,1-2H3
InChI Key:
RJUXTVOTTWLJHF-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N=Nc1cccc(c1)N=[N+](c1ccc(cc1)C)[O-]
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.148g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.391g/mol
Monoisotopic Mass:
330.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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