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10117-10-9 | Propanoic acid, 3-fluoro-, ethyl ester
CAS No: 10117-10-9 Catalog No: AG0003VW MDL No:
Product Description
Catalog Number:
AG0003VW
Chemical Name:
Propanoic acid, 3-fluoro-, ethyl ester
CAS Number:
10117-10-9
Molecular Formula:
C5H9FO2
Molecular Weight:
120.1222
IUPAC Name:
ethyl 3-fluoropropanoate
InChI:
InChI=1S/C5H9FO2/c1-2-8-5(7)3-4-6/h2-4H2,1H3
InChI Key:
HGWFSORGJISSEQ-UHFFFAOYSA-N
SMILES:
FCCC(=O)OCC
Properties
Complexity:
72.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.059g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
120.123g/mol
Monoisotopic Mass:
120.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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