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1006686-15-2 | 2-Pyridineacetic acid, 5-fluoro-, ethyl ester
CAS No: 1006686-15-2 Catalog No: AG0002L5 MDL No:
Product Description
Catalog Number:
AG0002L5
Chemical Name:
2-Pyridineacetic acid, 5-fluoro-, ethyl ester
CAS Number:
1006686-15-2
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
IUPAC Name:
ethyl 2-(5-fluoropyridin-2-yl)acetate
InChI:
InChI=1S/C9H10FNO2/c1-2-13-9(12)5-8-4-3-7(10)6-11-8/h3-4,6H,2,5H2,1H3
InChI Key:
JAGWOIBYFDAPHA-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1ccc(cn1)F
Properties
Complexity:
175
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:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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