1,2-Cyclopentanedicarboxylic acid, 4-oxo-, methyl phenylmethyl ester,cis-


Chemical Name: 1,2-Cyclopentanedicarboxylic acid, 4-oxo-, methyl phenylmethyl ester,cis-
CAS Number: 164916-54-5
Product Number: AG001V53(AGN-PC-0Q8NWM)
Synonyms:
MDL No:
Molecular Formula: C15H16O5
Molecular Weight: 276.2845

Identification/Properties


Computed Properties
Molecular Weight:
276.288g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
276.1g/mol
Monoisotopic Mass:
276.1g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
384
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
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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