Cyclopentaneacetic acid, 2-oxo-, ethyl ester


Chemical Name: Cyclopentaneacetic acid, 2-oxo-, ethyl ester
CAS Number: 20826-94-2
Product Number: AG002JLR(AGN-PC-0K2UJO)
Synonyms:
MDL No:
Molecular Formula: C9H14O3
Molecular Weight: 170.2057

Identification/Properties


Computed Properties
Molecular Weight:
170.208g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
170.094g/mol
Monoisotopic Mass:
170.094g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
186
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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