1-Methoxy-4-nitro-2-(trifluoromethyl)benzene

CAS Registry Number®

654-76-2
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CAS Name

1-Methoxy-4-nitro-2-(trifluoromethyl)benzene

Molecular Formula

C8H6F3NO3

Molecular Mass

221.13

Cite this Page

1-Methoxy-4-nitro-2-(trifluoromethyl)benzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=654-76-2 (retrieved 2024-04-30) (CAS RN: 654-76-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    79-79.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6F3NO3/c1-15-7-3-2-5(12(13)14)4-6(7)8(9,10)11/h2-4H,1H3

InChIKey

InChIKey=KGFADEJSZXEVMC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzene, 1-methoxy-4-nitro-2-(trifluoromethyl)-
  • Anisole, 4-nitro-2-(trifluoromethyl)-
  • 1-Methoxy-4-nitro-2-(trifluoromethyl)benzene
  • 2-Methoxy-5-nitrobenzotrifluoride
  • NSC 88331

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