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2,2'-Bipyridine-5,5'-dicarboxylic acid

Catalog Number
ACM1802308-3
Product Name
2,2'-Bipyridine-5,5'-dicarboxylic acid
Structure
CAS
1802-30-8
Category
Ligands for Functional Metal Complexes
Synonyms
6,6'-Binicotinic acid
IUPAC Name
6-(5-carboxypyridin-2-yl)pyridine-3-carboxylic acid
Molecular Weight
244.20
Molecular Formula
C12H8N2O4
Canonical SMILES
C1=CC(=NC=C1C(=O)O)C2=NC=C(C=C2)C(=O)O
InChI
KVQMUHHSWICEIH-UHFFFAOYSA-N
InChI Key
InChI=1S/C12H8N2O4/c15-11(16)7-1-3-9(13-5-7)10-4-2-8(6-14-10)12(17)18/h1-6H,(H,15,16)(H,17,18)
Boiling Point
521.0±50.0 °C(Predicted)
Melting Point
>360 °C-lit.
Purity
98%
Appearance
Off-white solid
Application
A Nicotinic acid (N429250) derivative for treatment of hypercholesterolemia and hyperlipidemia and cardiovascular disease.
Storage
Store under inert gas
Complexity
302
Covalently-Bonded Unit Count
1
Exact Mass
244.04840674
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
2
MDL Number
MFCD01318320
Monoisotopic Mass
244.04840674
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Refractive Index
1.62
Rotatable Bond Count
3
Signal Word
Warning
Specific Gravity
1.16
Topological Polar Surface Area
100 Ų
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