Irilone

CAS Registry Number®

41653-81-0
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CAS Name

Irilone

Molecular Formula

C16H10O6

Molecular Mass

298.25

Cite this Page

Irilone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=41653-81-0 (retrieved 2024-04-23) (CAS RN: 41653-81-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    236-237 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H10O6/c17-9-3-1-8(2-4-9)10-6-20-11-5-12-16(22-7-21-12)15(19)13(11)14(10)18/h1-6,17,19H,7H2

InChIKey

InChIKey=NUGRQNBDTZWXTP-UHFFFAOYSA-N

SMILES

O=C1C2=C(C=C3C(=C2O)OCO3)OC=C1C4=CC=C(O)C=C4

Canonical SMILES

O=C1C(=COC=2C=C3OCOC3=C(O)C12)C=4C=CC(O)=CC4

Other Names for this Substance

  • 8H-1,3-Dioxolo[4,5-g][1]benzopyran-8-one, 9-hydroxy-7-(4-hydroxyphenyl)-
  • 9-Hydroxy-7-(4-hydroxyphenyl)-8H-1,3-dioxolo[4,5-g][1]benzopyran-8-one
  • Irilone
  • Irilone (isoflavone)

CAS INSIGHTSTM
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