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40357-87-7 | 4-Hydroxy-1-methylpyridin-2(1H)-one
CAS No: 40357-87-7 Catalog No: AG00341U MDL No:MFCD01646151
Product Description
Catalog Number:
AG00341U
Chemical Name:
4-Hydroxy-1-methylpyridin-2(1H)-one
CAS Number:
40357-87-7
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD01646151
IUPAC Name:
4-hydroxy-1-methylpyridin-2-one
InChI:
InChI=1S/C6H7NO2/c1-7-3-2-5(8)4-6(7)9/h2-4,8H,1H3
InChI Key:
ISFRSMMUUQWJCU-UHFFFAOYSA-N
SMILES:
Oc1ccn(c(=O)c1)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:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Literature
| Title | Journal |
|---|---|
| N-Methyl-4-hydroxy-2-pyridinone analogues from Fusarium oxysporum. | Journal of natural products 20060301 |
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