200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1261977-99-4
1261977-99-4 | 2-Pyridinecarboxylic acid, 6-(4-fluoro-3-methoxyphenyl)-
CAS No: 1261977-99-4 Catalog No: AG000SAZ MDL No:MFCD18317543
Product Description
Catalog Number:
AG000SAZ
Chemical Name:
2-Pyridinecarboxylic acid, 6-(4-fluoro-3-methoxyphenyl)-
CAS Number:
1261977-99-4
Molecular Formula:
C13H10FNO3
Molecular Weight:
247.2218
MDL Number:
MFCD18317543
IUPAC Name:
6-(4-fluoro-3-methoxyphenyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C13H10FNO3/c1-18-12-7-8(5-6-9(12)14)10-3-2-4-11(15-10)13(16)17/h2-7H,1H3,(H,16,17)
InChI Key:
IWZVHUTZMULWDQ-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1F)c1cccc(n1)C(=O)O
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.064g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.225g/mol
Monoisotopic Mass:
247.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.