Cas no 19479-28-8 (Cyclopenta[c]pyran, 1,4a,5,6,7,7a-hexahydro-1-methoxy-4,7-dimethyl-, (1R,4aS,7R,7aR)-)

Cyclopenta[c]pyran, 1,4a,5,6,7,7a-hexahydro-1-methoxy-4,7-dimethyl-, (1R,4aS,7R,7aR)- structure
19479-28-8 structure
Product Name:Cyclopenta[c]pyran, 1,4a,5,6,7,7a-hexahydro-1-methoxy-4,7-dimethyl-, (1R,4aS,7R,7aR)-
CAS No:19479-28-8
MF:C11H18O2
MW:182.259423732758
CID:235334
PubChem ID:71356025
Update Time:2025-04-19

Cyclopenta[c]pyran, 1,4a,5,6,7,7a-hexahydro-1-methoxy-4,7-dimethyl-, (1R,4aS,7R,7aR)- Chemical and Physical Properties

Names and Identifiers

    • Cyclopenta[c]pyran, 1,4a,5,6,7,7a-hexahydro-1-methoxy-4,7-dimethyl-, (1R,4aS,7R,7aR)-
    • (1R,4aS,7R,7aR)-1-methoxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran
    • (1R)-1-Methoxymyodesert-3-ene
    • Cyclopenta[c]pyran, 1,4a,5,6,7,7a-hexahydro-1-methoxy-4,7-dimethyl-, [1R-(1a,4aa,7b,7aa)]-
    • Cyclopenta[c]pyran, 1,4aa,5,6,7,7a-hexahydro-1-methoxy-4,7b-dimethyl-(8CI)
    • Myodesert-3-ene, 1-methoxy-, (1R)-
    • Myodesertin
    • DTXSID50780188
    • 19479-28-8
    • (4aS,7R,7aR)-1-Methoxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran
    • Inchi: 1S/C11H18O2/c1-7-4-5-9-8(2)6-13-11(12-3)10(7)9/h6-7,9-11H,4-5H2,1-3H3/t7-,9-,10-,11-/m1/s1
    • InChI Key: IGZUHQCEDUZXSS-QCNRFFRDSA-N
    • SMILES: O1C=C(C)[C@H]2CC[C@@H](C)[C@H]2[C@@H]1OC

Computed Properties

  • Exact Mass: 182.13074
  • Monoisotopic Mass: 182.130679813g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 222
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • PSA: 18.46
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