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

CAS Registry Number®

32996-27-3

CAS Name

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

Molecular Formula

C8H7NO4

Molecular Mass

181.15

Cite this Page

5-Methyl-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=32996-27-3 (retrieved 2024-10-05) (CAS RN: 32996-27-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    102-104 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H7NO4/c1-5-2-7-8(13-4-12-7)3-6(5)9(10)11/h2-3H,4H2,1H3

InChIKey

InChIKey=HSJXVJRZFPZLSP-UHFFFAOYSA-N

SMILES

N(=O)(=O)C=1C=C2C(=CC1C)OCO2

Canonical SMILES

O=N(=O)C1=CC=2OCOC2C=C1C

Other Names for this Substance

  • 1,3-Benzodioxole, 5-methyl-6-nitro-
  • Toluene, 4,5-(methylenedioxy)-2-nitro-
  • 5-Methyl-6-nitro-1,3-benzodioxole
  • 5-Nitro-6-methyl-1,3-benzodioxole
  • 5-Methyl-6-nitrobenzodioxole

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