Cas no 54460-31-0 (Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester)

Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester structure
54460-31-0 structure
Product Name:Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester
CAS No:54460-31-0
MF:C11H16O5
MW:228.241744041443
CID:354516
PubChem ID:11622720
Update Time:2025-04-19

Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester
    • methyl 1-(2-acetyloxyethyl)-2-oxocyclopentane-1-carboxylate
    • 54460-31-0
    • SCHEMBL4349604
    • (+/-)-1-(2-acetoxyethyl)-2-oxocyclopentanecarboxylic acid methyl ester
    • NFBRFUYNZDQFNS-UHFFFAOYSA-N
    • 2-(2-Acetoxyethyl)-2-methoxycarbonylcyclopentanone
    • DTXSID70469600
    • Inchi： 1S/C11H16O5/c1-8(12)16-7-6-11(10(14)15-2)5-3-4-9(11)13/h3-7H2,1-2H3
    • InChI Key： NFBRFUYNZDQFNS-UHFFFAOYSA-N
    • SMILES： O=C1CCCC1(C(=O)OC)CCOC(C)=O

Computed Properties

  • Exact Mass: 228.09978
  • Monoisotopic Mass: 228.09977361g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 310
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.6
  • Topological Polar Surface Area: 69.7?2

Experimental Properties

  • PSA: 69.67

Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester Related Literature

54460-31-0 (Cyclopentanecarboxylic acid, 1-[2-(acetyloxy)ethyl]-2-oxo-, methyl ester) Related Products

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