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2-(pyridin-3-yl)-1H-imidazole-4,5-dicarboxylic acid

Name: 2-(pyridin-3-yl)-1H-imidazole-4,5-dicarboxylic acid
SKU: ACM1025042447-2
Rating: 5 (1 reviews)

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Catalog NumberACM1025042447-2

CAS Number1025042-44-7

CategoryCustomizable MOF Linkers

Synonyms

2-(2-Pyridyl)imidazole-4,5-dicarboxylic acid; 4-Carboxy-2-(pyridinium-2-yl)-1H-imidazole-5-carboxylate

IUPAC Name

2-pyridin-2-yl-1H-imidazole-4,5-dicarboxylic acid

Molecular Weight

233.18

Molecular Formula

C10H7N3O4

InChI

InChI=1S/C10H7N3O4/c14-9(15)6-7(10(16)17)13-8(12-6)5-3-1-2-4-11-5/h1-4H,(H,12,13)(H,14,15)(H,16,17)

InChI Key

MXZWGDSFWLUIET-UHFFFAOYSA-N

Purity

97%

Appearance

Off-white solid

Complexity

323

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

233.04365571g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

233.04365571g/mol

Rotatable Bond Count

SSA

~300m2/g

Topological Polar Surface Area

116Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

0.4

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