Cas no 169397-86-8 (Emoroidocarpan)

Emoroidocarpan structure
Emoroidocarpan structure
Product Name:Emoroidocarpan
CAS No:169397-86-8
MF:C21H18O5
MW:350.364626407623
CID:151978
Update Time:2024-03-01

Emoroidocarpan Chemical and Physical Properties

Names and Identifiers

    • 6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c]furo[3,2-g][1]benzopyran,1,2,6a,12a-tetrahydro-2-(1-methylethenyl)-, (6aR,12aR)-
    • Emoroidocarpan
    • 6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c]furo[3,2-g][1]benzopyran, 1,2,6a,12a-tetrahydro-2-(1-methylethenyl)-, (2R,6aR,12aR)-
    • Inchi: 1S/C21H18O5/c1-10(2)15-4-11-3-13-17(6-16(11)25-15)22-8-14-12-5-19-20(24-9-23-19)7-18(12)26-21(13)14/h3,5-7,14-15,21H,1,4,8-9H2,2H3
    • InChI Key: JDLWWTGCAJYSSZ-UHFFFAOYSA-N
    • SMILES: CC(C1OC2C(=CC3=C(C=2)OCC2C3OC3C2=CC2=C(OCO2)C=3)C1)=C

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 26
  • XLogP3: 2.068
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