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Home > Nitro Compounds > 13142-71-7
13142-71-7 | Urea, N-(2-methyl-4-nitrophenyl)-N'-phenyl-
CAS No: 13142-71-7 Catalog No: AG000W5A MDL No:
Product Description
Catalog Number:
AG000W5A
Chemical Name:
Urea, N-(2-methyl-4-nitrophenyl)-N'-phenyl-
CAS Number:
13142-71-7
Molecular Formula:
C14H13N3O3
Molecular Weight:
271.2713
IUPAC Name:
1-(2-methyl-4-nitrophenyl)-3-phenylurea
InChI:
InChI=1S/C14H13N3O3/c1-10-9-12(17(19)20)7-8-13(10)16-14(18)15-11-5-3-2-4-6-11/h2-9H,1H3,(H2,15,16,18)
InChI Key:
USFXVROWTKFBFA-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1C)[N+](=O)[O-])Nc1ccccc1
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.096g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
271.276g/mol
Monoisotopic Mass:
271.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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