3-Bromo-4-chlorobenzotrifluoride

CAS Registry Number®

454-78-4
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CAS Name

3-Bromo-4-chlorobenzotrifluoride

Molecular Formula

C7H3BrClF3

Molecular Mass

259.45

Cite this Page

3-Bromo-4-chlorobenzotrifluoride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=454-78-4 (retrieved 2024-04-26) (CAS RN: 454-78-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    191-192 °C @ Press: 740 Torr

  • Melting Point (1)

    -22.5--21.9 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H3BrClF3/c8-5-3-4(7(10,11)12)1-2-6(5)9/h1-3H

InChIKey

InChIKey=APSISOSWYXCEQX-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=CC(Br)=C(Cl)C=C1

Canonical SMILES

FC(F)(F)C1=CC=C(Cl)C(Br)=C1

Other Names for this Substance

  • Benzene, 2-bromo-1-chloro-4-(trifluoromethyl)-
  • Toluene, 3-bromo-4-chloro-α,α,α-trifluoro-
  • 2-Bromo-1-chloro-4-(trifluoromethyl)benzene
  • 3-Bromo-4-chloro-α,α,α-trifluorotoluene
  • 3-Bromo-4-chlorobenzotrifluoride

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