Cas no 88108-06-9 (Cyclohexanecarboperoxoic acid, 1-methyl-)

Cyclohexanecarboperoxoic acid, 1-methyl- structure
88108-06-9 structure
Product Name:Cyclohexanecarboperoxoic acid, 1-methyl-
CAS No:88108-06-9
MF:C8H14O3
MW:158.194962978363
CID:644756
PubChem ID:71410810
Update Time:2025-04-19

Cyclohexanecarboperoxoic acid, 1-methyl- Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanecarboperoxoic acid, 1-methyl-
    • 1-methylcyclohexane-1-carboperoxoic acid
    • DTXSID50830470
    • SCHEMBL8527912
    • 88108-06-9
    • Inchi: 1S/C8H14O3/c1-8(7(9)11-10)5-3-2-4-6-8/h10H,2-6H2,1H3
    • InChI Key: ZBKNULTWTHZRJV-UHFFFAOYSA-N
    • SMILES: O(C(C1(C)CCCCC1)=O)O

Computed Properties

  • Exact Mass: 158.094294304g/mol
  • Monoisotopic Mass: 158.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 147
  • 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: 2.1
  • Topological Polar Surface Area: 46.5?2
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