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1256787-03-7 | 2-Pyridinecarboxylic acid, 3-fluoro-5-methoxy-, methyl ester
CAS No: 1256787-03-7 Catalog No: AG000OCN MDL No:MFCD18256599
Product Description
Catalog Number:
AG000OCN
Chemical Name:
2-Pyridinecarboxylic acid, 3-fluoro-5-methoxy-, methyl ester
CAS Number:
1256787-03-7
Molecular Formula:
C8H8FNO3
Molecular Weight:
185.1524
MDL Number:
MFCD18256599
IUPAC Name:
methyl 3-fluoro-5-methoxypyridine-2-carboxylate
InChI:
InChI=1S/C8H8FNO3/c1-12-5-3-6(9)7(10-4-5)8(11)13-2/h3-4H,1-2H3
InChI Key:
KFHHZVJVEHZJFK-UHFFFAOYSA-N
SMILES:
COc1cnc(c(c1)F)C(=O)OC
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.154g/mol
Monoisotopic Mass:
185.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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