Cas no 55264-91-0 (4-Cyclohexene-1,2-dicarboxylic acid, 4,5-dimethyl-, dimethyl ester, cis-)

4-Cyclohexene-1,2-dicarboxylic acid, 4,5-dimethyl-, dimethyl ester, cis- structure
55264-91-0 structure
Product Name:4-Cyclohexene-1,2-dicarboxylic acid, 4,5-dimethyl-, dimethyl ester, cis-
CAS No:55264-91-0
MF:C12H18O4
MW:226.268924236298
CID:352403
PubChem ID:2767799
Update Time:2025-04-19

4-Cyclohexene-1,2-dicarboxylic acid, 4,5-dimethyl-, dimethyl ester, cis- Chemical and Physical Properties

Names and Identifiers

    • 4-Cyclohexene-1,2-dicarboxylic acid, 4,5-dimethyl-, dimethyl ester, cis-
    • dimethyl (1S,2R)-4,5-dimethylcyclohex-4-ene-1,2-dicarboxylate
    • 55264-91-0
    • 1,2-dimethyl (1R,2S)-4,5-dimethylcyclohex-4-ene-1,2-dicarboxylate
    • AKOS005078811
    • dimethyl (1R,2S)-4,5-dimethyl-4-cyclohexene-1,2-dicarboxylate
    • MFCD02571655
    • 1,2-dimethyl(1R,2S)-4,5-dimethylcyclohex-4-ene-1,2-dicarboxylate
    • DTXSID20377625
    • 11P-149
    • Inchi: 1S/C12H18O4/c1-7-5-9(11(13)15-3)10(6-8(7)2)12(14)16-4/h9-10H,5-6H2,1-4H3/t9-,10+
    • InChI Key: DRIHIJXHHLHRAL-AOOOYVTPSA-N
    • SMILES: O(C)C([C@H]1CC(C)=C(C)C[C@H]1C(=O)OC)=O

Computed Properties

  • Exact Mass: 226.12054
  • Monoisotopic Mass: 226.12050905g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 298
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • PSA: 52.6

4-Cyclohexene-1,2-dicarboxylic acid, 4,5-dimethyl-, dimethyl ester, cis- Pricemore >>

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