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178913-13-8 | Diazenecarboxamide, N-(3-methylphenyl)-2-phenyl-
CAS No: 178913-13-8 Catalog No: AG0026I7 MDL No:
Product Description
Catalog Number:
AG0026I7
Chemical Name:
Diazenecarboxamide, N-(3-methylphenyl)-2-phenyl-
CAS Number:
178913-13-8
Molecular Formula:
C14H13N3O
Molecular Weight:
239.2725
IUPAC Name:
1-(3-methylphenyl)-3-phenyliminourea
InChI:
InChI=1S/C14H13N3O/c1-11-6-5-9-13(10-11)15-14(18)17-16-12-7-3-2-4-8-12/h2-10H,1H3,(H,15,18)
InChI Key:
PDBOZZBIWZXNTJ-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)C)N=Nc1ccccc1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.106g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.278g/mol
Monoisotopic Mass:
239.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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