Home Carboxys 1-(2-Chlorobenzyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid

1-(2-Chlorobenzyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid

CAS No.:
66158-19-8
Catalog Number:
AG006JGV
Molecular Formula:
C13H10ClNO3
Molecular Weight:
263.6764
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Product Description
Catalog Number:
AG006JGV
Chemical Name:
1-(2-Chlorobenzyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CAS Number:
66158-19-8
Molecular Formula:
C13H10ClNO3
Molecular Weight:
263.6764
MDL Number:
MFCD00140815
IUPAC Name:
1-[(2-chlorophenyl)methyl]-2-oxopyridine-3-carboxylic acid
InChI:
InChI=1S/C13H10ClNO3/c14-11-6-2-1-4-9(11)8-15-7-3-5-10(12(15)16)13(17)18/h1-7H,8H2,(H,17,18)
InChI Key:
IMCXRWVIOONIMQ-UHFFFAOYSA-N
SMILES:
Clc1ccccc1Cn1cccc(c1=O)C(=O)O
Properties
Complexity:
417  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.035g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.677g/mol
Monoisotopic Mass:
263.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties