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2-Pyridin-4-Yl-3H-Benzoimidazole-5-Carboxylic Acid

Catalog Number
ACM316833326
Product Name
2-Pyridin-4-Yl-3H-Benzoimidazole-5-Carboxylic Acid
Structure
CAS
316833-32-6
Category
Carboxylic acid nitrogen-containing mixed MOF ligand-binary mixed ligand
Synonyms
2-PYRIDIN-4-YL-3H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID;2-Pyridin-4-yl-3H-benzimidazole-5-carboxylic acid;2-Pyridin-4-yl-1H-benzimidazole-5-carboxylic acid
IUPAC Name
2-pyridin-4-yl-3H-benzimidazole-5-carboxylic acid
Molecular Weight
239.23
Molecular Formula
C13H9N3O2
InChI
InChI=1S/C13H9N3O2/c17-13(18)9-1-2-10-11(7-9)16-12(15-10)8-3-5-14-6-4-8/h1-7H,(H,15,16)(H,17,18)
InChI Key
TYFICRRCLJYFJU-UHFFFAOYSA-N
Density
1.439g/cm³
Complexity
317
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
239.069476538g/mol
Formal Charge
0
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
2
Isotope Atom Count
0
Length
0.5-2 um
Monoisotopic Mass
239.069476538g/mol
Rotatable Bond Count
2
SSA
>200 m2/g
Topological Polar Surface Area
78.9Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.6
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