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85314-03-0 | Diazene, (4-methoxyphenyl)(4-methylphenyl)-, 1-oxide
CAS No: 85314-03-0 Catalog No: AG004LOU MDL No:
Product Description
Catalog Number:
AG004LOU
Chemical Name:
Diazene, (4-methoxyphenyl)(4-methylphenyl)-, 1-oxide
CAS Number:
85314-03-0
Molecular Formula:
C14H14N2O2
Molecular Weight:
242.2732
IUPAC Name:
(4-methoxyphenyl)imino-(4-methylphenyl)-oxidoazanium
InChI:
InChI=1S/C14H14N2O2/c1-11-3-7-13(8-4-11)16(17)15-12-5-9-14(18-2)10-6-12/h3-10H,1-2H3
InChI Key:
DMOUMCBTTDKQME-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N=[N+](c1ccc(cc1)C)[O-]
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.278g/mol
Monoisotopic Mass:
242.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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