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Home Carboxys 1-isobutyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid

1-isobutyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid

CAS No.:
954225-48-0
Catalog Number:
AG01BTU0
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
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Product Description
Catalog Number:
AG01BTU0
Chemical Name:
1-isobutyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CAS Number:
954225-48-0
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD09756126
IUPAC Name:
1-(2-methylpropyl)-2-oxopyridine-3-carboxylic acid
InChI:
InChI=1S/C10H13NO3/c1-7(2)6-11-5-3-4-8(9(11)12)10(13)14/h3-5,7H,6H2,1-2H3,(H,13,14)
InChI Key:
YUOLVABBLIARGH-UHFFFAOYSA-N
SMILES:
CC(Cn1cccc(c1=O)C(=O)O)C
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties