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1214328-79-6 | 2-Pyridinecarboxylic acid, 3-fluoro-6-methoxy-
CAS No: 1214328-79-6 Catalog No: AG0014SP MDL No:MFCD13185873
Product Description
Catalog Number:
AG0014SP
Chemical Name:
2-Pyridinecarboxylic acid, 3-fluoro-6-methoxy-
CAS Number:
1214328-79-6
Molecular Formula:
C7H6FNO3
Molecular Weight:
171.1258
MDL Number:
MFCD13185873
IUPAC Name:
3-fluoro-6-methoxypyridine-2-carboxylic acid
InChI:
InChI=1S/C7H6FNO3/c1-12-5-3-2-4(8)6(9-5)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key:
AXSBPWGUSHDMMC-UHFFFAOYSA-N
SMILES:
COc1ccc(c(n1)C(=O)O)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.127g/mol
Monoisotopic Mass:
171.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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