Cas no 88805-65-6 (3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester)

3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester structure
88805-65-6 structure
Product Name:3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester
CAS No:88805-65-6
MF:C9H12O4
MW:184.189183235168
MDL:MFCD19441209
CID:710132
PubChem ID:10559379
Update Time:2025-04-19

3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester
    • ethyl 3-hydroxy-5-oxo-3-cyclohexene-1-carboxylate
    • ethyl 3-hydroxy-5-oxocyclohex-3-ene-1-carboxylate
    • NS00002523
    • A1-04730
    • Ethyl-3-hydroxy-5-oxo-cyclohex-3-enecarboxylate
    • 88805-65-6
    • SSXUXPNPVFUMDJ-UHFFFAOYSA-N
    • E77116
    • C9H12O4
    • Ethyl-3-hydroxy-5-oxo-cyclohex-3-ene carboxylate
    • Ethyl 3-hydroxy-5-oxocyclohex-3-enecarboxylate
    • CS-0199257
    • ethyl 3-hydroxy-5-oxo-cyclohexa-3-ene carboxylate
    • DTXSID80441694
    • SCHEMBL3922985
    • 3-Hydroxy-5-oxo-cyclohex-3-enecarboxylic acid ethyl ester
    • Ethyl3-hydroxy-5-oxocyclohex-3-enecarboxylate
    • EC 414-450-4
    • MDL: MFCD19441209
    • Inchi: 1S/C9H12O4/c1-2-13-9(12)6-3-7(10)5-8(11)4-6/h5-6,10H,2-4H2,1H3
    • InChI Key: SSXUXPNPVFUMDJ-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1CC(C=C(C1)O)=O)=O

Computed Properties

  • Exact Mass: 184.07355886g/mol
  • Monoisotopic Mass: 184.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 254
  • 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: 0.1
  • Topological Polar Surface Area: 63.6?2

3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester Security Information

3-Cyclohexene-1-carboxylicacid, 3-hydroxy-5-oxo-, ethyl ester Pricemore >>

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