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84784-24-7 | Urea, N'-(4-chlorophenyl)-N-(4-methylphenyl)-N-nitroso-
CAS No: 84784-24-7 Catalog No: AG004OM7 MDL No:
Product Description
Catalog Number:
AG004OM7
Chemical Name:
Urea, N'-(4-chlorophenyl)-N-(4-methylphenyl)-N-nitroso-
CAS Number:
84784-24-7
Molecular Formula:
C14H12ClN3O2
Molecular Weight:
289.7170
IUPAC Name:
3-(4-chlorophenyl)-1-(4-methylphenyl)-1-nitrosourea
InChI:
InChI=1S/C14H12ClN3O2/c1-10-2-8-13(9-3-10)18(17-20)14(19)16-12-6-4-11(15)5-7-12/h2-9H,1H3,(H,16,19)
InChI Key:
GJISXFVZUSBTLD-UHFFFAOYSA-N
SMILES:
O=NN(c1ccc(cc1)C)C(=O)Nc1ccc(cc1)Cl
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.062g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.719g/mol
Monoisotopic Mass:
289.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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