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Home > Nitro Compounds > 86488-76-8
86488-76-8 | Urea, N,N'-bis(4-methoxyphenyl)-N-nitroso-
CAS No: 86488-76-8 Catalog No: AG004M2J MDL No:
Product Description
Catalog Number:
AG004M2J
Chemical Name:
Urea, N,N'-bis(4-methoxyphenyl)-N-nitroso-
CAS Number:
86488-76-8
Molecular Formula:
C15H15N3O4
Molecular Weight:
301.2973
IUPAC Name:
1,3-bis(4-methoxyphenyl)-1-nitrosourea
InChI:
InChI=1S/C15H15N3O4/c1-21-13-7-3-11(4-8-13)16-15(19)18(17-20)12-5-9-14(22-2)10-6-12/h3-10H,1-2H3,(H,16,19)
InChI Key:
ZPYDEOBOVLGAJJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)N(c1ccc(cc1)OC)N=O
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.106g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.302g/mol
Monoisotopic Mass:
301.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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