Home Nitros 2(1H)-Pyridinone, 4,6-dimethyl-3-nitro-

2(1H)-Pyridinone, 4,6-dimethyl-3-nitro-

CAS No.:
22934-13-0
Catalog Number:
AG00I4IB
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
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Product Description
Catalog Number:
AG00I4IB
Chemical Name:
2(1H)-Pyridinone, 4,6-dimethyl-3-nitro-
CAS Number:
22934-13-0
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD06809625
IUPAC Name:
4,6-dimethyl-3-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C7H8N2O3/c1-4-3-5(2)8-7(10)6(4)9(11)12/h3H,1-2H3,(H,8,10)
InChI Key:
NACUUHJKIYEVFA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)cc([nH]c1=O)C
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties