Cas no 17672-88-7 ((E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole)

(E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole is a substituted benzodioxole derivative characterized by its distinct molecular structure, featuring dimethoxy and propenyl functional groups. This compound is of interest in organic synthesis and pharmaceutical research due to its potential as a building block for more complex molecules. The presence of the (E)-propenyl group enhances its reactivity in cross-coupling and cyclization reactions, while the benzodioxole core contributes to stability and bioactivity. Its well-defined stereochemistry and purity make it suitable for applications in medicinal chemistry, particularly in the development of bioactive compounds. The compound is typically handled under controlled conditions to preserve its integrity.
(E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole structure
17672-88-7 structure
Product Name:(E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole
CAS No:17672-88-7
MF:C12H14O4
MW:222.237164020538
CID:2042804
PubChem ID:15559838
Update Time:2025-06-07

(E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole Chemical and Physical Properties

Names and Identifiers

    • (E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole
    • 4,7-Dimethoxy-5-(1-propenyl)-1,3-benzodioxol
    • 4,7-Dimethoxy-5-propenyl-benzo[1,3]dioxol
    • 4,7-dimethoxy-5-propenyl-benzo[1,3]dioxole
    • 4,7-Dimethoxy-5-trans-propenyl-benzo[1,3]dioxol
    • 4,7-dimethoxy-5-trans-propenyl-benzo[1,3]dioxole
    • isoapiol
    • isoapiole
    • 4,7-Dimethoxy-5-[(E)-1-propenyl]-1,3-benzodioxole
    • AKOS005604289
    • DTXSID401318670
    • 17672-88-7
    • 4,7-Dimethoxy-5-[prop-1-en-1-yl]-2H-1,3-benzodioxole
    • CHEMBL1642211
    • 4,7-DIMETHOXY-5-[(1E)-PROP-1-EN-1-YL]-2H-1,3-BENZODIOXOLE
    • CCG-321601
    • 4,7-dimethoxy-5-[(E)-prop-1-enyl]-1,3-benzodioxole
    • XKCIPTFOQRVXGG-SNAWJCMRSA-N
    • STK692715
    • 4,7-dimethoxy-5-[(1E)-prop-1-en-1-yl]-1,3-benzodioxole
    • 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+
    • InChI Key： XKCIPTFOQRVXGG-SNAWJCMRSA-N
    • SMILES： O1COC2C(=CC(/C=C/C)=C(C1=2)OC)OC

Computed Properties

  • Exact Mass: 222.08920892g/mol
  • Monoisotopic Mass: 222.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 253
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 36.9?2

Experimental Properties

  • Density: 1.1995 (rough estimate)
  • Melting Point: 56°C
  • Boiling Point: 303.5°C (estimate)
  • Refractive Index: 1.5360 (estimate)

(E)-4,7-dimethoxy-5-(1-propenyl)-1,3-benzodioxole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB553414-500 mg
4,7-Dimethoxy-5-[(1E)-prop-1-en-1-yl]-1,3-benzodioxole; .
 17672-88-7
500MG
 €688.90 2022-03-24
abcr
AB553414-1 g
4,7-Dimethoxy-5-[(1E)-prop-1-en-1-yl]-1,3-benzodioxole; .
 17672-88-7
1g
 €935.40 2022-03-24

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