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1158763-56-4 | 2-Pyridinecarboxylic acid, 5-(2-fluorophenyl)-
CAS No: 1158763-56-4 Catalog No: AG000H0M MDL No:MFCD12406463
Product Description
Catalog Number:
AG000H0M
Chemical Name:
2-Pyridinecarboxylic acid, 5-(2-fluorophenyl)-
CAS Number:
1158763-56-4
Molecular Formula:
C12H8FNO2
Molecular Weight:
217.1958
MDL Number:
MFCD12406463
IUPAC Name:
5-(2-fluorophenyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C12H8FNO2/c13-10-4-2-1-3-9(10)8-5-6-11(12(15)16)14-7-8/h1-7H,(H,15,16)
InChI Key:
BOCBXJDDFWXTNN-UHFFFAOYSA-N
SMILES:
Fc1ccccc1c1ccc(nc1)C(=O)O
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.054g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.199g/mol
Monoisotopic Mass:
217.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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