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13143-38-9

13143-38-9 | Urea, N-(3-methylphenyl)-N'-(3-nitrophenyl)-

CAS No: 13143-38-9 Catalog No: AG000W64 MDL No:

Product Description

Catalog Number:
AG000W64
Chemical Name:
Urea, N-(3-methylphenyl)-N'-(3-nitrophenyl)-
CAS Number:
13143-38-9
Molecular Formula:
C14H13N3O3
Molecular Weight:
271.2713
IUPAC Name:
1-(3-methylphenyl)-3-(3-nitrophenyl)urea
InChI:
InChI=1S/C14H13N3O3/c1-10-4-2-5-11(8-10)15-14(18)16-12-6-3-7-13(9-12)17(19)20/h2-9H,1H3,(H2,15,16,18)
InChI Key:
FDXXISXKXKUWAC-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)C)Nc1cccc(c1)[N+](=O)[O-]

Properties

Complexity:
356  
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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