Aspidinol

CAS Registry Number®

519-40-4

CAS Name

Aspidinol

Molecular Formula

C12H16O4

Molecular Mass

224.25

Cite this Page

Aspidinol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=519-40-4 (retrieved 2024-12-19) (CAS RN: 519-40-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    156-161 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C12H16O4/c1-4-5-8(13)11-9(14)6-10(16-3)7(2)12(11)15/h6,14-15H,4-5H2,1-3H3

InChIKey

InChIKey=GJRJTYFSORWKBE-UHFFFAOYSA-N

SMILES

C(CCC)(=O)C1=C(O)C(C)=C(OC)C=C1O

Canonical SMILES

O=C(C1=C(O)C=C(OC)C(=C1O)C)CCC

Other Names for this Substance

  • 1-Butanone, 1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)-
  • Butyrophenone, 2′,6′-dihydroxy-4′-methoxy-3′-methyl-
  • Aspidinol
  • 1-(2,6-Dihydroxy-4-methoxy-3-methylphenyl)-1-butanone
  • 4-Butyryl-3,5-dihydroxy-1-methoxy-2-methylbenzene

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