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14761-60-5 | [2,2'-Bipyridine]-6-carboxylic acid, 4-methoxy-
CAS No: 14761-60-5 Catalog No: AG001F1H MDL No:
Product Description
Catalog Number:
AG001F1H
Chemical Name:
[2,2'-Bipyridine]-6-carboxylic acid, 4-methoxy-
CAS Number:
14761-60-5
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
IUPAC Name:
4-methoxy-6-pyridin-2-ylpyridine-2-carboxylic acid
InChI:
InChI=1S/C12H10N2O3/c1-17-8-6-10(9-4-2-3-5-13-9)14-11(7-8)12(15)16/h2-7H,1H3,(H,15,16)
InChI Key:
BUKMVABABVOCFI-UHFFFAOYSA-N
SMILES:
COc1cc(nc(c1)c1ccccn1)C(=O)O
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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