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[2,2'-Bipyridine]-3,3'-dicarboxylic acid

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Catalog Number

ACM4433016-3

Product Name

Structure

CAS

4433-01-6

Synonyms

2,2'-Binicotinic Acid

IUPAC Name

2-(3-carboxypyridin-2-yl)pyridine-3-carboxylic acid;

Molecular Weight

244.20

Molecular Formula

C12H8N2O4

Canonical SMILES

C1=CC(=C(N=C1)C2=C(C=CC=N2)C(=O)O)C(=O)O;

InChI

InChI=1S/C12H8N2O4/c15-11(16)7-3-1-5-13-9(7)10-8(12(17)18)4-2-6-14-10/h1-6H,(H,15,16)(H,17,18);

InChI Key

KNVZVRWMLMPTTJ-UHFFFAOYSA-N;

Purity

98%

Appearance

White solid powder

Complexity

302

Covalently-Bonded Unit Count

Exact Mass

244.048g/mol

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

244.048g/mol

Rotatable Bond Count

Topological Polar Surface Area

100A^2

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