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144564-17-0 | Cyclopentanecarboxylic acid, 1-fluoro-2,5-dioxo-, ethyl ester
CAS No: 144564-17-0 Catalog No: AG001JRH MDL No:
Product Description
Catalog Number:
AG001JRH
Chemical Name:
Cyclopentanecarboxylic acid, 1-fluoro-2,5-dioxo-, ethyl ester
CAS Number:
144564-17-0
Molecular Formula:
C8H9FO4
Molecular Weight:
188.1531
IUPAC Name:
ethyl 1-fluoro-2,5-dioxocyclopentane-1-carboxylate
InChI:
InChI=1S/C8H9FO4/c1-2-13-7(12)8(9)5(10)3-4-6(8)11/h2-4H2,1H3
InChI Key:
PEGMNYUZWSKCFM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(F)C(=O)CCC1=O
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.154g/mol
Monoisotopic Mass:
188.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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