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7164-95-6 | 3-Hexanoyl-4-hydroxy-6-methyl-2(1H)-pyridinone
CAS No: 7164-95-6 Catalog No: AG00FRD3 MDL No:
Product Description
Catalog Number:
AG00FRD3
Chemical Name:
3-Hexanoyl-4-hydroxy-6-methyl-2(1H)-pyridinone
CAS Number:
7164-95-6
IUPAC Name:
3-hexanoyl-4-hydroxy-6-methyl-1H-pyridin-2-one
InChI:
InChI=1S/C12H17NO3/c1-3-4-5-6-9(14)11-10(15)7-8(2)13-12(11)16/h7H,3-6H2,1-2H3,(H2,13,15,16)
InChI Key:
DKCSTRWQJIMOQO-UHFFFAOYSA-N
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.272g/mol
Monoisotopic Mass:
223.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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