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Home Other Building Blocks 2-(Pyridin-2-yl)benzoic acid

2-(Pyridin-2-yl)benzoic acid

CAS No.:
13764-20-0
Catalog Number:
AG0013O4
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
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Product Description
Catalog Number:
AG0013O4
Chemical Name:
2-(Pyridin-2-yl)benzoic acid
CAS Number:
13764-20-0
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
MDL Number:
MFCD11848836
IUPAC Name:
2-pyridin-2-ylbenzoic acid
InChI:
InChI=1S/C12H9NO2/c14-12(15)10-6-2-1-5-9(10)11-7-3-4-8-13-11/h1-8H,(H,14,15)
InChI Key:
KTSUSQZZJTZSFA-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1c1ccccn1
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.063g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.209g/mol
Monoisotopic Mass:
199.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Tetra-aqua-bis-[3-(pyridin-4-yl)benzoato-κN]manganese(II). Acta crystallographica. Section E, Structure reports online 20120501
Tetra-aqua-bis-[3-(pyridin-4-yl)benzoato-κN]cobalt(II). Acta crystallographica. Section E, Structure reports online 20111201
A novel helical double-layered cobalt(II)-organic framework with tetranuclear [Co4(mu3-OH)2] clusters linked by an unsymmetrical pyridylbenzoate ligand. Inorganic chemistry 20071029
Properties