Cas no 5410-22-0 (2-methyl-7-oxabicyclo[4.1.0]heptane)

2-methyl-7-oxabicyclo[4.1.0]heptane structure
5410-22-0 structure
Product Name:2-methyl-7-oxabicyclo[4.1.0]heptane
CAS No:5410-22-0
MF:C7H12O
MW:112.169582366943
CID:939694
PubChem ID:224244
Update Time:2025-04-19

2-methyl-7-oxabicyclo[4.1.0]heptane Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-7-oxabicyclo[4.1.0]heptane
    • 1,2-Epoxy-3-methylcyclohexane
    • 5-methyl-7-oxabicyclo[4.1.0]heptane
    • 1,2-Epoxy-3-methylcyclohexan
    • 1,2-Epoxy-3-methyl-cyclohexan
    • 1,2-epoxy-3-methyl-cyclohexane
    • 1-methylcyclohexene oxide
    • 3-Methylcyclohexene oxide
    • 7-Oxabicyclo[4.1.0]heptane, 2-methyl-
    • AC1L5D5I
    • AC1Q6ZZ0
    • AR-1H3879
    • CTK4J9585
    • NSC12598
    • NRFMZKXHPJBQBW-UHFFFAOYSA-N
    • NSC-12598
    • 3-methylepoxycyclohexane
    • KJH6YZ4H3B
    • 5410-22-0
    • DTXSID10279402
    • 2-Methyl-7-oxabicyclo[4.1.0]heptane #
    • SCHEMBL2248175
    • 3-Methylcyclohexene epoxide
    • Inchi: 1S/C7H12O/c1-5-3-2-4-6-7(5)8-6/h5-7H,2-4H2,1H3
    • InChI Key: NRFMZKXHPJBQBW-UHFFFAOYSA-N
    • SMILES: O1C2CCCC(C)C12

Computed Properties

  • Exact Mass: 112.08886
  • Monoisotopic Mass: 112.088815002g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 101
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 12.5?2

Experimental Properties

  • PSA: 12.53
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