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Home > Pyridines > 157033-88-0
157033-88-0 | 2,4(1H,3H)-Pyridinedione, 6-methyl-
CAS No: 157033-88-0 Catalog No: AG001P62 MDL No:MFCD18811982
Product Description
Catalog Number:
AG001P62
Chemical Name:
2,4(1H,3H)-Pyridinedione, 6-methyl-
CAS Number:
157033-88-0
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD18811982
IUPAC Name:
6-methyl-1H-pyridine-2,4-dione
InChI:
InChI=1S/C6H7NO2/c1-4-2-5(8)3-6(9)7-4/h2H,3H2,1H3,(H,7,9)
InChI Key:
OJHDKKODJFEBGJ-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)C=C(N1)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.127g/mol
Monoisotopic Mass:
125.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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