Cas no 282736-14-5 (Isoplagiochin C; 2,12-Dichloro, 7',8'-dihydro)

Isoplagiochin C; 2,12-Dichloro, 7',8'-dihydro structure
282736-14-5 structure
Product Name:Isoplagiochin C; 2,12-Dichloro, 7',8'-dihydro
CAS No:282736-14-5
MF:C28H22Cl2O4
MW:493.377886295319
CID:6699028
Update Time:2024-03-02

Isoplagiochin C; 2,12-Dichloro, 7',8'-dihydro Chemical and Physical Properties

Names and Identifiers

    • 2,12-Dichloroisoplagiochin D
    • Isoplagiochin C; 2,12-Dichloro, 7',8'-dihydro
    • Inchi: 1S/C28H22Cl2O4/c29-23-14-20-18(13-27(23)33)6-3-17-10-22(28(34)24(30)11-17)21-9-15(5-8-25(21)31)1-2-16-4-7-19(20)26(32)12-16/h4-5,7-14,31-34H,1-3,6H2
    • InChI Key: LJSXPWWNJOGXBB-UHFFFAOYSA-N
    • SMILES: OC1C(Cl)=CC2=C(CCC3C=C(C4C(O)=CC=C(CCC5C=C(O)C2=CC=5)C=4)C(O)=C(Cl)C=3)C=1

Computed Properties

  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 34
  • XLogP3: 4.492
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