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Home > Pyridines > 909867-61-4
909867-61-4 | 4(1H)-Pyridinone, 3-butyl-2-methyl-
CAS No: 909867-61-4 Catalog No: AG006FS5 MDL No:
Product Description
Catalog Number:
AG006FS5
Chemical Name:
4(1H)-Pyridinone, 3-butyl-2-methyl-
CAS Number:
909867-61-4
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
IUPAC Name:
3-butyl-2-methyl-1H-pyridin-4-one
InChI:
InChI=1S/C10H15NO/c1-3-4-5-9-8(2)11-7-6-10(9)12/h6-7H,3-5H2,1-2H3,(H,11,12)
InChI Key:
JJDKYHNAMRCPNN-UHFFFAOYSA-N
SMILES:
Cc1c(CCCC)c(=O)cc[nH]1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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