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1219503-87-3 | 3-Pyridinecarboxylic acid, 2-(2,4-difluorophenyl)-, ethyl ester
CAS No: 1219503-87-3 Catalog No: AG0016GA MDL No:MFCD14636487
Product Description
Catalog Number:
AG0016GA
Chemical Name:
3-Pyridinecarboxylic acid, 2-(2,4-difluorophenyl)-, ethyl ester
CAS Number:
1219503-87-3
Molecular Formula:
C14H11F2NO2
Molecular Weight:
263.2394
MDL Number:
MFCD14636487
IUPAC Name:
ethyl 2-(2,4-difluorophenyl)pyridine-3-carboxylate
InChI:
InChI=1S/C14H11F2NO2/c1-2-19-14(18)11-4-3-7-17-13(11)10-6-5-9(15)8-12(10)16/h3-8H,2H2,1H3
InChI Key:
HQBVIAUGIPKJHW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccnc1c1ccc(cc1F)F
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.076g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.244g/mol
Monoisotopic Mass:
263.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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