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1261831-63-3 | 2-Pyridinecarboxylic acid, 6-(2,3-difluorophenyl)-, ethyl ester
CAS No: 1261831-63-3 Catalog No: AG000S1V MDL No:MFCD18405135
Product Description
Catalog Number:
AG000S1V
Chemical Name:
2-Pyridinecarboxylic acid, 6-(2,3-difluorophenyl)-, ethyl ester
CAS Number:
1261831-63-3
Molecular Formula:
C14H11F2NO2
Molecular Weight:
263.2394
MDL Number:
MFCD18405135
IUPAC Name:
ethyl 6-(2,3-difluorophenyl)pyridine-2-carboxylate
InChI:
InChI=1S/C14H11F2NO2/c1-2-19-14(18)12-8-4-7-11(17-12)9-5-3-6-10(15)13(9)16/h3-8H,2H2,1H3
InChI Key:
PHDIUBHOTWAKDN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(n1)c1cccc(c1F)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:
3.3
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