Home Other Building Blocks 3-(4-hydroxy-6-methyl-2-oxo-1,2-dihydropyridin-1-yl)propanoic acid

3-(4-hydroxy-6-methyl-2-oxo-1,2-dihydropyridin-1-yl)propanoic acid

CAS No.:
904809-32-1
Catalog Number:
AG019YXK
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
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Product Description
Catalog Number:
AG019YXK
Chemical Name:
3-(4-hydroxy-6-methyl-2-oxo-1,2-dihydropyridin-1-yl)propanoic acid
CAS Number:
904809-32-1
Molecular Formula:
C9H11NO4
Molecular Weight:
197.1879
MDL Number:
MFCD08568507
IUPAC Name:
3-(4-hydroxy-2-methyl-6-oxopyridin-1-yl)propanoic acid
InChI:
InChI=1S/C9H11NO4/c1-6-4-7(11)5-8(12)10(6)3-2-9(13)14/h4-5,11H,2-3H2,1H3,(H,13,14)
InChI Key:
QTULSHJBUBOZOY-UHFFFAOYSA-N
SMILES:
OC(=O)CCn1c(C)cc(cc1=O)O
Properties
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.19g/mol
Monoisotopic Mass:
197.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties