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1260784-53-9 | 2-Pyridinecarboxylic acid, 4-chloro-3-fluoro-, ethyl ester
CAS No: 1260784-53-9 Catalog No: AG000R8N MDL No:MFCD16610958
Product Description
Catalog Number:
AG000R8N
Chemical Name:
2-Pyridinecarboxylic acid, 4-chloro-3-fluoro-, ethyl ester
CAS Number:
1260784-53-9
Molecular Formula:
C8H7ClFNO2
Molecular Weight:
203.5981
MDL Number:
MFCD16610958
IUPAC Name:
ethyl 3-fluoro-2-methylpyridine-4-carboxylate
InChI:
InChI=1S/C9H10FNO2/c1-3-13-9(12)7-4-5-11-6(2)8(7)10/h4-5H,3H2,1-2H3
InChI Key:
XQSHBGAAYLGXJE-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nccc(c1F)Cl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.182g/mol
Monoisotopic Mass:
183.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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