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6,6'-Binicotinic acid

Catalog Number
ACM1802308-1
Product Name
6,6'-Binicotinic acid
Structure
CAS
1802-30-8
Category
Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand
IUPAC Name
6-(5-carboxypyridin-2-yl)pyridine-3-carboxylic acid
Molecular Weight
244.20g/mol
Molecular Formula
C12H8N2O4
InChI
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)
InChI Key
KVQMUHHSWICEIH-UHFFFAOYSA-N
Complexity
302
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
244.04840674g/mol
Formal Charge
0
Hazard Statements
10workdays
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
6
Hydrogen Bond Donor Count
2
Isotope Atom Count
0
MeSH Entry Terms
(2,2'-bipyridine)-5,5'-dicarboxylic acid;2,2'-bipy-5,5'-diCOOH
Monoisotopic Mass
244.04840674g/mol
Rotatable Bond Count
3
Safety Description
XFF29
Supplemental Hazard Statements
50mg
Topological Polar Surface Area
100Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
WGK Germany
D:~100 nm
XLogP3
0.5
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