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Home Carboxys 2,2'-Bipyridine-3,3'-dicarboxylic acid dimethyl ester

2,2'-Bipyridine-3,3'-dicarboxylic acid dimethyl ester

CAS No.:
39775-31-0
Catalog Number:
AG00CLFM
Molecular Formula:
C14H12N2O4
Molecular Weight:
272.2561
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Product Description
Catalog Number:
AG00CLFM
Chemical Name:
2,2'-Bipyridine-3,3'-dicarboxylic acid dimethyl ester
CAS Number:
39775-31-0
Molecular Formula:
C14H12N2O4
Molecular Weight:
272.2561
MDL Number:
MFCD00226069
IUPAC Name:
methyl 2-(3-methoxycarbonylpyridin-2-yl)pyridine-3-carboxylate
InChI:
InChI=1S/C14H12N2O4/c1-19-13(17)9-5-3-7-15-11(9)12-10(14(18)20-2)6-4-8-16-12/h3-8H,1-2H3
InChI Key:
SQQPYWUOEFGOCD-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccnc1c1ncccc1C(=O)OC
NSC Number:
91837
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.08g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.26g/mol
Monoisotopic Mass:
272.08g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Dimethyl 6,6'-dicyano-2,2'-bipyridine-3,3'-dicarboxyl-ate. Acta crystallographica. Section E, Structure reports online 20090501
Anti-tubercular activity of ruthenium (II) complexes with polypyridines. Journal of enzyme inhibition and medicinal chemistry 20090401
Properties