Cas no 88239-03-6 (Undecanoic acid, 4-[(acetyloxy)methyl]-5-oxo-, methyl ester)

Undecanoic acid, 4-[(acetyloxy)methyl]-5-oxo-, methyl ester structure
88239-03-6 structure
Product Name:Undecanoic acid, 4-[(acetyloxy)methyl]-5-oxo-, methyl ester
CAS No:88239-03-6
MF:C15H26O5
MW:286.363945484161
CID:640134
PubChem ID:13140462
Update Time:2025-04-19

Undecanoic acid, 4-[(acetyloxy)methyl]-5-oxo-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • Undecanoic acid, 4-[(acetyloxy)methyl]-5-oxo-, methyl ester
    • methyl 4-(acetyloxymethyl)-5-oxoundecanoate
    • DTXSID90521193
    • METHYL 4-[(ACETYLOXY)METHYL]-5-OXOUNDECANOATE
    • 88239-03-6
    • Inchi: 1S/C15H26O5/c1-4-5-6-7-8-14(17)13(11-20-12(2)16)9-10-15(18)19-3/h13H,4-11H2,1-3H3
    • InChI Key: RXTXIOBJJYJPNC-UHFFFAOYSA-N
    • SMILES: O(C(C)=O)CC(C(CCCCCC)=O)CCC(=O)OC

Computed Properties

  • Exact Mass: 286.17802393g/mol
  • Monoisotopic Mass: 286.17802393g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 13
  • Complexity: 311
  • 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: 2.4
  • Topological Polar Surface Area: 69.7?2
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