Khellinone

CAS Registry Number®

484-51-5

CAS Name

Khellinone

Molecular Formula

C12H12O5

Molecular Mass

236.22

Cite this Page

Khellinone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=484-51-5 (retrieved 2024-11-22) (CAS RN: 484-51-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    90-101 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12O5/c1-6(13)8-9(14)12(16-3)11-7(4-5-17-11)10(8)15-2/h4-5,14H,1-3H3

InChIKey

InChIKey=GEUAWNMVARSYHO-UHFFFAOYSA-N

SMILES

O(C)C1=C2C(=C(OC)C(C(C)=O)=C1O)C=CO2

Canonical SMILES

O=C(C1=C(O)C(OC)=C2OC=CC2=C1OC)C

Other Names for this Substance

  • Ethanone, 1-(6-hydroxy-4,7-dimethoxy-5-benzofuranyl)-
  • Ketone, 6-hydroxy-4,7-dimethoxy-5-benzofuranyl methyl
  • Khellinone
  • 1-(6-Hydroxy-4,7-dimethoxy-5-benzofuranyl)ethanone
  • 6-Hydroxy-4,7-dimethoxy-5-benzofuranyl methyl ketone

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