Cas no 66696-89-7 (UNDECANOIC ACID, 3-OXO-, ETHYL ESTER)

UNDECANOIC ACID, 3-OXO-, ETHYL ESTER structure
66696-89-7 structure
Product Name:UNDECANOIC ACID, 3-OXO-, ETHYL ESTER
CAS No:66696-89-7
MF:C13H24O3
MW:228.327864646912
CID:3542708
PubChem ID:12425354
Update Time:2025-04-22

UNDECANOIC ACID, 3-OXO-, ETHYL ESTER Chemical and Physical Properties

Names and Identifiers

    • UNDECANOIC ACID, 3-OXO-, ETHYL ESTER
    • ethyl 3-oxoundecanoate
    • 3-Oxo-undecanoic acid ethyl ester
    • ethyl3-oxoundecanoate
    • MFCD30183587
    • SCHEMBL6138788
    • BKALCQBTSJOFLT-UHFFFAOYSA-N
    • G72564
    • 66696-89-7
    • Inchi: 1S/C13H24O3/c1-3-5-6-7-8-9-10-12(14)11-13(15)16-4-2/h3-11H2,1-2H3
    • InChI Key: BKALCQBTSJOFLT-UHFFFAOYSA-N
    • SMILES: O=C(CC(=O)OCC)CCCCCCCC

Computed Properties

  • Exact Mass: 228.17254462g/mol
  • Monoisotopic Mass: 228.17254462g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 11
  • Complexity: 199
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.9
  • Topological Polar Surface Area: 43.4?2

UNDECANOIC ACID, 3-OXO-, ETHYL ESTER Pricemore >>

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