Cas no 11054-58-3 (Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,(3aS,5S,6E,10Z,11aR)-)

Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,(3aS,5S,6E,10Z,11aR)- structure
11054-58-3 structure
Product Name:Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,(3aS,5S,6E,10Z,11aR)-
CAS No:11054-58-3
MF:C19H24O6
MW:348.390266418457
CID:167205
Update Time:2024-03-01

Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,(3aS,5S,6E,10Z,11aR)- Chemical and Physical Properties

Names and Identifiers

    • Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,(3aS,5S,6E,10Z,11aR)-
    • Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,(3aS,5S,6E,10
    • Cyclodeca[b]furan-2(3H)-one,5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-,[3aS-(3aR*,5R*,6E,10Z,11aS*)]-
    • Idomain
    • Stenophyllolide, diacetate (8CI)
    • Cyclodeca[b]furan-2(3H)-one, 5-(acetyloxy)-10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-methyl-3-methylene-, (3aS,5S,6E,10Z,11aR)-
    • Inchi: 1S/C19H24O6/c1-11-6-5-7-15(10-23-13(3)20)8-18-16(12(2)19(22)25-18)9-17(11)24-14(4)21/h6,8,16-18H,2,5,7,9-10H2,1,3-4H3/b11-6+,15-8-/t16-,17-,18+/m0/s1
    • InChI Key: UAGIDIZQJQHUEH-MWEJNTSSSA-N
    • SMILES: O1C(=O)C(=C)[C@]2([H])C[C@H](OC(C)=O)C(C)=CCCC(COC(C)=O)=C[C@@]12[H] |t:14,23|

Computed Properties

  • Exact Mass: 348.15732
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 25
  • XLogP3: 1.721

Experimental Properties

  • Density: 1.17±0.1 g/cm3(Predicted)
  • Boiling Point: 495.2±45.0 °C(Predicted)
  • PSA: 78.9
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