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695-19-2 | 1-Methyl-4(1H)-pyridinone
CAS No: 695-19-2 Catalog No: AG00FDWF MDL No:
Product Description
Catalog Number:
AG00FDWF
Chemical Name:
1-Methyl-4(1H)-pyridinone
CAS Number:
695-19-2
IUPAC Name:
1-methylpyridin-4-one
InChI:
InChI=1S/C6H7NO/c1-7-4-2-6(8)3-5-7/h2-5H,1H3
InChI Key:
OYPBUQASUUMJKG-UHFFFAOYSA-N
UNII:
Z9CD9U6U11
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Literature
| Title | Journal |
|---|---|
| Carbanions from decarboxylation of orotate analogs: stability and mechanistic implications. | Bioorganic chemistry 20070801 |
| Stability of the 6-carbanion of uracil analogues: mechanistic implications for model reactions of orotidine-5'-monophosphate decarboxylase. | Organic letters 20061221 |
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