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Home > Pyridines > 204717-51-1
204717-51-1 | 4(1H)-Pyridinone, 2-ethyl-3-hydroxy-1-(4-methylphenyl)-
CAS No: 204717-51-1 Catalog No: AG0029NS MDL No:
Product Description
Catalog Number:
AG0029NS
Chemical Name:
4(1H)-Pyridinone, 2-ethyl-3-hydroxy-1-(4-methylphenyl)-
CAS Number:
204717-51-1
Molecular Formula:
C14H15NO2
Molecular Weight:
229.2744
IUPAC Name:
2-ethyl-3-hydroxy-1-(4-methylphenyl)pyridin-4-one
InChI:
InChI=1S/C14H15NO2/c1-3-12-14(17)13(16)8-9-15(12)11-6-4-10(2)5-7-11/h4-9,17H,3H2,1-2H3
InChI Key:
VLTGLOSJFNCLFI-UHFFFAOYSA-N
SMILES:
CCc1c(O)c(=O)ccn1c1ccc(cc1)C
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.11g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.279g/mol
Monoisotopic Mass:
229.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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