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1214339-84-0 | [3,3'-Bipyridine]-6-carboxylic acid
CAS No: 1214339-84-0 Catalog No: AG0014TJ MDL No:
Product Description
Catalog Number:
AG0014TJ
Chemical Name:
[3,3'-Bipyridine]-6-carboxylic acid
CAS Number:
1214339-84-0
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
IUPAC Name:
5-pyridin-3-ylpyridine-2-carboxylic acid
InChI:
InChI=1S/C11H8N2O2/c14-11(15)10-4-3-9(7-13-10)8-2-1-5-12-6-8/h1-7H,(H,14,15)
InChI Key:
KEZVNXXJTWWOGL-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cn1)c1cccnc1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.059g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.197g/mol
Monoisotopic Mass:
200.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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