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887983-05-3 | 2-Pyridinecarboxylicacid, 6-(2,4-difluorophenyl)-
CAS No: 887983-05-3 Catalog No: AG004ARM MDL No:MFCD06410082
Product Description
Catalog Number:
AG004ARM
Chemical Name:
2-Pyridinecarboxylicacid, 6-(2,4-difluorophenyl)-
CAS Number:
887983-05-3
Molecular Formula:
C12H7F2NO2
Molecular Weight:
235.1863
MDL Number:
MFCD06410082
IUPAC Name:
6-(2,4-difluorophenyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C12H7F2NO2/c13-7-4-5-8(9(14)6-7)10-2-1-3-11(15-10)12(16)17/h1-6H,(H,16,17)
InChI Key:
FUNOQGWVZGTACQ-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)c1cccc(n1)C(=O)O
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.044g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.19g/mol
Monoisotopic Mass:
235.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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