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17310-79-1 | Diazene, 1-(4-methylphenyl)-2-phenyl-, 2-oxide
CAS No: 17310-79-1 Catalog No: AG001YMO MDL No:
Product Description
Catalog Number:
AG001YMO
Chemical Name:
Diazene, 1-(4-methylphenyl)-2-phenyl-, 2-oxide
CAS Number:
17310-79-1
Molecular Formula:
C13H12N2O
Molecular Weight:
212.2472
IUPAC Name:
(4-methylphenyl)-oxido-phenyliminoazanium
InChI:
InChI=1S/C13H12N2O/c1-11-7-9-13(10-8-11)15(16)14-12-5-3-2-4-6-12/h2-10H,1H3
InChI Key:
QBBVVBKEFHNUBO-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N=[N+](c1ccccc1)[O-]
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.252g/mol
Monoisotopic Mass:
212.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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