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Home > Pyridines > 1019107-97-1
1019107-97-1 | 2-(6-Methyl-pyridin-3-yloxy)-nicotinic acid
CAS No: 1019107-97-1 Catalog No: AG01FATA MDL No:
Product Description
Catalog Number:
AG01FATA
Chemical Name:
2-(6-Methyl-pyridin-3-yloxy)-nicotinic acid
CAS Number:
1019107-97-1
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
IUPAC Name:
2-(6-methylpyridin-3-yl)oxypyridine-3-carboxylic acid
InChI:
InChI=1S/C12H10N2O3/c1-8-4-5-9(7-14-8)17-11-10(12(15)16)3-2-6-13-11/h2-7H,1H3,(H,15,16)
InChI Key:
QUIUMNCOKVAQER-UHFFFAOYSA-N
SMILES:
Cc1ccc(cn1)Oc1ncccc1C(=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:
1.6
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