Cas no 777918-08-8 (3-Cyclopentene-1-carboxylicacid, 2-methyl-, methyl ester, (1S,2S)-)

3-Cyclopentene-1-carboxylicacid, 2-methyl-, methyl ester, (1S,2S)- structure
777918-08-8 structure
Product Name:3-Cyclopentene-1-carboxylicacid, 2-methyl-, methyl ester, (1S,2S)-
CAS No:777918-08-8
MF:C8H12O2
MW:140.179682731628
CID:553115
PubChem ID:45089901
Update Time:2025-04-19

3-Cyclopentene-1-carboxylicacid, 2-methyl-, methyl ester, (1S,2S)- Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclopentene-1-carboxylicacid, 2-methyl-, methyl ester, (1S,2S)-
    • 3-Cyclopentene-1-carboxylicacid,2-methyl-,methylester,(1S,2S)-(9CI)
    • 777918-08-8
    • Inchi: 1S/C8H12O2/c1-6-4-3-5-7(6)8(9)10-2/h3-4,6-7H,5H2,1-2H3/t6-,7-/m0/s1
    • InChI Key: KOIOQUNLIZTNKL-BQBZGAKWSA-N
    • SMILES: O(C)C([C@H]1CC=C[C@@H]1C)=O

Computed Properties

  • Exact Mass: 140.084
  • Monoisotopic Mass: 140.084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 161
  • 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
  • Topological Polar Surface Area: 26.3A^2
  • XLogP3: 1.6
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