Cas no 118141-23-4 (9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one,2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl-)

9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one,2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl- structure
118141-23-4 structure
Product Name:9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one,2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl-
CAS No:118141-23-4
MF:C20H18O7
MW:370.352726459503
CID:218670
Update Time:2024-03-01

9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one,2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl- Chemical and Physical Properties

Names and Identifiers

    • 9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one,2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl-
    • Jatrophin
    • 9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one, 2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl-
    • Inchi: 1S/C20H18O7/c1-10-17(11-4-6-13(21)14(8-11)23-2)27-20-18-12(5-7-16(22)26-18)9-15(24-3)19(20)25-10/h4-10,17,21H,1-3H3
    • InChI Key: NDEQJXOUOQJARH-UHFFFAOYSA-N
    • SMILES: O1C2=C(OC)C=C3C=CC(=O)OC3=C2OC(C2=CC=C(O)C(OC)=C2)C1C

Computed Properties

  • Exact Mass: 370.10524

Experimental Properties

  • Density: 1.338±0.06 g/cm3(Predicted)
  • Boiling Point: 578.3±50.0 °C(Predicted)
  • PSA: 87.36
  • pka: 9.65±0.35(Predicted)
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