(1E)-1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one

CAS Registry Number®

144850-45-3
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CAS Name

(1E)-1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one

Molecular Formula

C14H16O3

Molecular Mass

232.27

Cite this Page

(1E)-1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=144850-45-3 (retrieved 2024-07-07) (CAS RN: 144850-45-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    93-94 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H16O3/c1-14(2,3)13(15)7-5-10-4-6-11-12(8-10)17-9-16-11/h4-8H,9H2,1-3H3/b7-5+

InChIKey

InChIKey=LXFNQCGNCFRKRR-FNORWQNLSA-N

SMILES

C(=C/C(C(C)(C)C)=O)\C=1C=C2C(=CC1)OCO2

Canonical SMILES

O=C(C=CC1=CC=C2OCOC2=C1)C(C)(C)C

Other Names for this Substance

  • 1-Penten-3-one, 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-, (1E)-
  • 1-Penten-3-one, 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-, (E)-
  • (1E)-1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one