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139261-92-0

139261-92-0 | 4(1H)-Pyridinone, 1-ethyl-3-hydroxy-2-(1-hydroxyethyl)-

CAS No: 139261-92-0 Catalog No: AG001ALP MDL No:

Product Description

Catalog Number:
AG001ALP
Chemical Name:
4(1H)-Pyridinone, 1-ethyl-3-hydroxy-2-(1-hydroxyethyl)-
CAS Number:
139261-92-0
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
IUPAC Name:
1-ethyl-3-hydroxy-2-(1-hydroxyethyl)pyridin-4-one
InChI:
InChI=1S/C9H13NO3/c1-3-10-5-4-7(12)9(13)8(10)6(2)11/h4-6,11,13H,3H2,1-2H3
InChI Key:
KICQOVVEMVVNSD-UHFFFAOYSA-N
SMILES:
CCn1ccc(=O)c(c1C(O)C)O

Properties

Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Literature

Title Journal
Basic 3-hydroxypyridin-4-ones: potential antimalarial agents. European journal of medicinal chemistry 20080501

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