5-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-4-hydroxy-6-methoxy-1(3H)-isobenzofuranone

CAS Registry Number®

126654-52-2

CAS Name

5-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-4-hydroxy-6-methoxy-1(3H)-isobenzofuranone

Molecular Formula

C19H22O5

Molecular Mass

330.38

Cite this Page

5-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-4-hydroxy-6-methoxy-1(3H)-isobenzofuranone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=126654-52-2 (retrieved 2024-11-08) (CAS RN: 126654-52-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    134-136 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H22O5/c1-11(2)7-13(20)8-12(3)5-6-14-17(23-4)9-15-16(18(14)21)10-24-19(15)22/h5,7,9,21H,6,8,10H2,1-4H3/b12-5+

InChIKey

InChIKey=IDSCVDJWBRGNKG-LFYBBSHMSA-N

SMILES

OC1=C2C(=CC(OC)=C1C/C=C(/CC(C=C(C)C)=O)\C)C(=O)OC2

Canonical SMILES

O=C1OCC2=C(O)C(=C(OC)C=C12)CC=C(C)CC(=O)C=C(C)C

Other Names for this Substance

  • 1(3H)-Isobenzofuranone, 5-[(2E)-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-4-hydroxy-6-methoxy-
  • 1(3H)-Isobenzofuranone, 5-(3,7-dimethyl-5-oxo-2,6-octadienyl)-4-hydroxy-6-methoxy-, (E)-
  • 1(3H)-Isobenzofuranone, 5-[(2E)-3,7-dimethyl-5-oxo-2,6-octadienyl]-4-hydroxy-6-methoxy-
  • 5-[(2E)-3,7-Dimethyl-5-oxo-2,6-octadien-1-yl]-4-hydroxy-6-methoxy-1(3H)-isobenzofuranone
  • Hericenone A

CAS INSIGHTSTM
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