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29342-11-8 | 2(1H)-Pyridinone, 6-(2-cyclohexylethyl)-1-hydroxy-4-methyl-
CAS No: 29342-11-8 Catalog No: AG002Y3I MDL No:
Product Description
Catalog Number:
AG002Y3I
Chemical Name:
2(1H)-Pyridinone, 6-(2-cyclohexylethyl)-1-hydroxy-4-methyl-
CAS Number:
29342-11-8
Molecular Formula:
C14H21NO2
Molecular Weight:
235.3220
IUPAC Name:
6-(2-cyclohexylethyl)-1-hydroxy-4-methylpyridin-2-one
InChI:
InChI=1S/C14H21NO2/c1-11-9-13(15(17)14(16)10-11)8-7-12-5-3-2-4-6-12/h9-10,12,17H,2-8H2,1H3
InChI Key:
IRLOXNZCACBROX-UHFFFAOYSA-N
SMILES:
Cc1cc(CCC2CCCCC2)n(c(=O)c1)O
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.157g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.327g/mol
Monoisotopic Mass:
235.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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