Home Carboxys 5-ethyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid

5-ethyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid

CAS No.:
1248969-30-3
Catalog Number:
AG01E91I
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG01E91I
Chemical Name:
5-ethyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CAS Number:
1248969-30-3
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD16834366
IUPAC Name:
5-ethyl-2-oxo-1H-pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H9NO3/c1-2-5-3-6(8(11)12)7(10)9-4-5/h3-4H,2H2,1H3,(H,9,10)(H,11,12)
InChI Key:
NVAGFQYNASHIGM-UHFFFAOYSA-N
SMILES:
CCc1c[nH]c(=O)c(c1)C(=O)O
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties