Isoapiole

CAS Registry Number®

17672-88-7
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CAS Name

Isoapiole

Molecular Formula

C12H14O4

Molecular Mass

222.24

Cite this Page

Isoapiole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17672-88-7 (retrieved 2024-05-09) (CAS RN: 17672-88-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    56.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H14O4/c1-4-5-8-6-9(13-2)11-12(10(8)14-3)16-7-15-11/h4-6H,7H2,1-3H3/b5-4+

InChIKey

InChIKey=XKCIPTFOQRVXGG-SNAWJCMRSA-N

SMILES

O(C)C1=C2C(=C(OC)C=C1/C=C/C)OCO2

Canonical SMILES

O(C=1C=C(C=CC)C(OC)=C2OCOC12)C

Other Names for this Substance

  • 1,3-Benzodioxole, 4,7-dimethoxy-5-(1E)-1-propen-1-yl-
  • Benzene, 1,4-dimethoxy-2,3-(methylenedioxy)-5-propenyl-, (E)-
  • Isoapiole
  • 1,3-Benzodioxole, 4,7-dimethoxy-5-(1-propenyl)-, (E)-
  • 1,3-Benzodioxole, 4,7-dimethoxy-5-(1E)-1-propenyl-

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