5-Bromo-6-nitro-1,3-benzodioxole

CAS Registry Number®

7748-58-5

CAS Name

5-Bromo-6-nitro-1,3-benzodioxole

Molecular Formula

C7H4BrNO4

Molecular Mass

246.01

Cite this Page

5-Bromo-6-nitro-1,3-benzodioxole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7748-58-5 (retrieved 2024-11-22) (CAS RN: 7748-58-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    89 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H4BrNO4/c8-4-1-6-7(13-3-12-6)2-5(4)9(10)11/h1-2H,3H2

InChIKey

InChIKey=WXXFALFBNSJISM-UHFFFAOYSA-N

SMILES

N(=O)(=O)C=1C=C2C(=CC1Br)OCO2

Canonical SMILES

O=N(=O)C=1C=C2OCOC2=CC1Br

Other Names for this Substance

  • 1,3-Benzodioxole, 5-bromo-6-nitro-
  • Benzene, 1-bromo-4,5-(methylenedioxy)-2-nitro-
  • 5-Bromo-6-nitro-1,3-benzodioxole
  • 2-Bromo-4,5-methylenedioxynitrobenzene
  • 2-Bromo-3,4-methylenedioxynitrobenzene

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