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2,2'-Bipyridine-3,3'-dicarboxylic Acid

Catalog Number
ACM4433016-1
CAS Number
4433-01-6
Product Name
2,2'-Bipyridine-3,3'-dicarboxylic Acid
Structure
Category
Metal Organic Frameworks (MOFs); Ligands for Functional Metal Complexes
Synonyms
2,2'-Bipyridine-4,4'-dicarboxylic acid dimethyl ester,4,4'-Bis(methoxycarbonyl)-2,2'-bipyridine,4,4'-Dimethoxycarbonyl-2,2'-bipyridine
IUPAC Name
2-(3-carboxypyridin-2-yl)pyridine-3-carboxylic acid
Molecular Weight
244
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
Melting Point
208-212 ℃
Purity
≥98%
Appearance
White to Almost white powder to crystal
Storage
Store under inert gas
Complexity
302
Covalently-Bonded Unit Count
1
Exact Mass
244.048407g/mol
Formal Charge
0
Hazard Statements
H315 H318 H335
Heavy Atom Count
18
MDL Number
MFCD00226068
Monoisotopic Mass
244.048407g/mol
Precautionary Statements
P261 P280 P305+P351+P338
Refractive Index
1.62
Rotatable Bond Count
3
Signal Word
Danger
Specific Gravity
1.16
XLogP3
0.5
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