Elemicin

CAS Registry Number®

487-11-6

CAS Name

Elemicin

Molecular Formula

C12H16O3

Molecular Mass

208.25

Cite this Page

Elemicin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=487-11-6 (retrieved 2024-11-22) (CAS RN: 487-11-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    152-156 °C

  • Density (2)

    1.0630 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5,7-8H,1,6H2,2-4H3

InChIKey

InChIKey=BPLQKQKXWHCZSS-UHFFFAOYSA-N

SMILES

O(C)C1=C(OC)C=C(CC=C)C=C1OC

Canonical SMILES

O(C=1C=C(C=C(OC)C1OC)CC=C)C

Other Names for this Substance

  • Benzene, 1,2,3-trimethoxy-5-(2-propen-1-yl)-
  • Elemicin
  • Benzene, 5-allyl-1,2,3-trimethoxy-
  • Benzene, 1,2,3-trimethoxy-5-(2-propenyl)-
  • 1,2,3-Trimethoxy-5-(2-propen-1-yl)benzene

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