Home Nitros 1-Methyl-3-(4-nitrophenyl)urea

1-Methyl-3-(4-nitrophenyl)urea

CAS No.:
13866-64-3
Catalog Number:
AG00AJMJ
Molecular Formula:
C8H9N3O3
Molecular Weight:
195.1754
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Product Description
Catalog Number:
AG00AJMJ
Chemical Name:
1-Methyl-3-(4-nitrophenyl)urea
CAS Number:
13866-64-3
Molecular Formula:
C8H9N3O3
Molecular Weight:
195.1754
MDL Number:
MFCD09040539
IUPAC Name:
1-methyl-3-(4-nitrophenyl)urea
InChI:
InChI=1S/C8H9N3O3/c1-9-8(12)10-6-2-4-7(5-3-6)11(13)14/h2-5H,1H3,(H2,9,10,12)
InChI Key:
KLRUCOUQQILQEI-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.064g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.178g/mol
Monoisotopic Mass:
195.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties