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Home > Pyridines > 129689-53-8
129689-53-8 | 2(1H)-Pyridinone, 5-acetyl-1,3-dimethyl-
CAS No: 129689-53-8 Catalog No: AG000TLW MDL No:
Product Description
Catalog Number:
AG000TLW
Chemical Name:
2(1H)-Pyridinone, 5-acetyl-1,3-dimethyl-
CAS Number:
129689-53-8
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
IUPAC Name:
5-acetyl-1,3-dimethylpyridin-2-one
InChI:
InChI=1S/C9H11NO2/c1-6-4-8(7(2)11)5-10(3)9(6)12/h4-5H,1-3H3
InChI Key:
VKGHTCONPVUCTB-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(C)c(=O)n(c1)C
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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