1-Methoxy-3,5-dinitrobenzene

CAS Registry Number®

5327-44-6

CAS Name

1-Methoxy-3,5-dinitrobenzene

Molecular Formula

C7H6N2O5

Molecular Mass

198.13

Cite this Page

1-Methoxy-3,5-dinitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5327-44-6 (retrieved 2024-11-22) (CAS RN: 5327-44-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    105.3 °C
  • Density (2)

    1.61 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H6N2O5/c1-14-7-3-5(8(10)11)2-6(4-7)9(12)13/h2-4H,1H3

InChIKey

InChIKey=OTMLGCBMOMNGCV-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC(N(=O)=O)=CC(OC)=C1

Canonical SMILES

O=N(=O)C1=CC(OC)=CC(=C1)N(=O)=O

Other Names for this Substance

  • Benzene, 1-methoxy-3,5-dinitro-
  • Anisole, 3,5-dinitro-
  • 1-Methoxy-3,5-dinitrobenzene
  • 3,5-Dinitroanisole
  • NSC 3331

CAS INSIGHTSTM
Targeted protein degrader structure, illustration