Cas no 63097-59-6 (2-Methylcyclopent-1-ene-1-peroxol)

2-Methylcyclopent-1-ene-1-peroxol structure
63097-59-6 structure
Product Name:2-Methylcyclopent-1-ene-1-peroxol
CAS No:63097-59-6
MF:C6H10O2
MW:114.142402172089
CID:2789689
PubChem ID:71373362
Update Time:2025-04-21

2-Methylcyclopent-1-ene-1-peroxol Chemical and Physical Properties

Names and Identifiers

    • 63097-59-6
    • methylcyclopentenyl hydroperoxide
    • DTXCID40746930
    • 2-Methylcyclopent-1-ene-1-peroxol
    • DTXSID90796187
    • Inchi: 1S/C6H10O2/c1-5-3-2-4-6(5)8-7/h7H,2-4H2,1H3
    • InChI Key: QPOCVHADJBZOTF-UHFFFAOYSA-N
    • SMILES: O(C1=C(C)CCC1)O

Computed Properties

  • Exact Mass: 114.068079557g/mol
  • Monoisotopic Mass: 114.068079557g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 116
  • 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: 0.9
  • Topological Polar Surface Area: 29.5?2
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