Cas no 6698-13-1 (4-bromo-2H-1,3-benzodioxole)

4-bromo-2H-1,3-benzodioxole structure
4-bromo-2H-1,3-benzodioxole structure
Product Name:4-bromo-2H-1,3-benzodioxole
CAS No:6698-13-1
MF:C7H5BrO2
MW:201.017401456833
MDL:MFCD02681890
CID:503005
PubChem ID:2776189
Update Time:2025-04-19

4-bromo-2H-1,3-benzodioxole Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-1,3-benzodioxole
    • 1,3-Benzodioxole,4-bromo-
    • 4-BROMOBENZO[D][1,3]DIOXOLE
    • 4-bromo-2H-1,3-benzodioxole
    • 4-Bromo-benzo[1,3]dioxole
    • 4-Bromo-1,3-dioxaindane
    • 1,3-Benzodioxole, 4-bromo-
    • 2,3-Methylenedioxy-bromobenzene
    • 4-bromo-1,3-benzodioxol
    • methylene dioxy bromo-benzene
    • 4-bromanyl-1,3-benzodioxole
    • 1,3-benzodioxol-4-yl bromide
    • VZPMQHSDFWAZHP-UHFFFAOYSA-N
    • 4-bromo-2H-benzo[d]1,3-dioxolene
    • SBB092702
    • PB47509
    • Z1269207841
    • 6698-13-1
    • DTXSID10379875
    • SY021228
    • AMY40617
    • CS-W022086
    • MFCD02681890
    • A835600
    • EN300-251346
    • AC-26518
    • SCHEMBL263096
    • J-514532
    • FT-0617699
    • FS-3254
    • AKOS015900041
    • 4-Bromo-benzo[1,3]dioxole; 4-bromo-2H-1,3-benzodioxole
    • MDL: MFCD02681890
    • Inchi: 1S/C7H5BrO2/c8-5-2-1-3-6-7(5)10-4-9-6/h1-3H,4H2
    • InChI Key: VZPMQHSDFWAZHP-UHFFFAOYSA-N
    • SMILES: BrC1=CC=CC2=C1OCO2

Computed Properties

  • Exact Mass: 199.94700
  • Monoisotopic Mass: 199.94729g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 129
  • 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
  • Topological Polar Surface Area: 18.5
  • XLogP3: 2.4

Experimental Properties

  • Boiling Point: 82-83℃(p=0.6 torr)(lit.)
  • PSA: 18.46000
  • LogP: 2.17780

4-bromo-2H-1,3-benzodioxole Security Information

  • Hazard Statement: H302-H315-H319-H335
  • Safety Instruction: S26-S37/39
  • Hazardous Material Identification: Xi
  • Storage Condition:Sealed in dry,2-8°C
  • Risk Phrases:R36/37/38
  • Safety Term:S26;S37/39

4-bromo-2H-1,3-benzodioxole 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%

4-bromo-2H-1,3-benzodioxole Pricemore >>

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