Cas no 6006-82-2 (2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol)

2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol is a benzodioxole derivative characterized by its ethanolic hydroxyl functional group attached to a benzodioxole core. This compound is of interest in organic synthesis and pharmaceutical research due to its structural similarity to biologically active molecules, such as safrole derivatives. Its key advantages include its role as a versatile intermediate in the preparation of fragrances, flavoring agents, and potential therapeutic compounds. The benzodioxole moiety enhances stability and influences metabolic pathways, making it valuable for medicinal chemistry applications. The hydroxyl group provides a reactive site for further functionalization, enabling tailored modifications for specific research or industrial needs.
2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol structure
6006-82-2 structure
Product Name:2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol
CAS No:6006-82-2
MF:C9H10O3
MW:166.173902988434
MDL:MFCD00666033
CID:507017
PubChem ID:2759846
Update Time:2025-06-09

2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol Chemical and Physical Properties

Names and Identifiers

    • 2-(Benzo[d][1,3]dioxol-5-yl)ethanol
    • 1,3-Benzodioxole-5-ethanol
    • 2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol
    • 2-(1,3-Benzodioxol-5-yl)ethanol
    • 2-(3,4-Methylenedioxyphenyl)ethanol
    • 2-(3,4-Methylenedioxyphenyl)ethyl alcohol
    • 3,4-(Methylenedioxy)phenethyl alcohol
    • Homopiperonyl alcohol
    • 3,4-Methylenedioxyphenethyl alcohol
    • 2-(1,3-benzodioxol-5-yl)-ethanol
    • benzodioxolylethanol
    • Homopiperonylalkohol
    • JADSGOFBFPTCHG-UHFFFAOYSA-N
    • 3,4-methylenedioxyphenyl-1-ethanol
    • 2-benzo[1,3]dioxol-5-yl-ethanol
    • 6478AE
    • 3,4-Methylenedioxyphenylethylalcohol
    • MFCD00666033
    • SY063780
    • D97583
    • 6006-82-2
    • EN300-732938
    • SCHEMBL834910
    • 2-(1,3-dioxaindan-5-yl)ethan-1-ol
    • 5-(2-Hydroxyethyl)-1,3-benzodioxolane
    • DB-053524
    • AKOS006345710
    • 2-(Benzo[d][1,3]dioxol-5-yl)ethan-1-ol
    • 2-(2H-1,3-benzodioxol-5-yl)ethanol
    • DTXSID80374938
    • 3,4-(methylenedioxy)phenethyl alcohol, AldrichCPR
    • CS-0147887
    • EF-0746
    • J-506214
    • MDL： MFCD00666033
    • Inchi： 1S/C9H10O3/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5,10H,3-4,6H2
    • InChI Key： JADSGOFBFPTCHG-UHFFFAOYSA-N
    • SMILES： O1COC2C=CC(=CC1=2)CCO

Computed Properties

  • Exact Mass: 166.06300
  • Monoisotopic Mass: 166.063
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 149
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 38.7

Experimental Properties

  • Density: 1.269±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 150-153 oC (9 Torr)
  • Flash Point: 127.2±18.7 oC,
  • Refractive Index: 1.578
  • Solubility: Slightly soluble (2.7 g/l) (25 o C),
  • PSA: 38.69000
  • LogP: 0.95010

2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol Security Information

  • Hazard Category Code： 41
  • Safety Instruction： 26-39
  • Hazardous Material Identification： Xi
  • HazardClass：IRRITANT

2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol Customs Data

  • HS CODE：2932999099
  • Customs Data：

    China Customs Code:

    2932999099

    Overview:

    2932999099. Other heterocyclic compounds containing only oxygen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-(2H-1,3-Benzodioxol-5-yl)ethan-1-ol Pricemore >>

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