1-Fluoro-4-isothiocyanato-2-(trifluoromethyl)benzene

CAS Registry Number®

302912-43-2
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CAS Name

1-Fluoro-4-isothiocyanato-2-(trifluoromethyl)benzene

Molecular Formula

C8H3F4NS

Molecular Mass

221.17

Cite this Page

1-Fluoro-4-isothiocyanato-2-(trifluoromethyl)benzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=302912-43-2 (retrieved 2024-05-04) (CAS RN: 302912-43-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    228-230 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H3F4NS/c9-7-2-1-5(13-4-14)3-6(7)8(10,11)12/h1-3H

InChIKey

InChIKey=QBKIGUJFPYMZPS-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=CC(N=C=S)=CC=C1F

Canonical SMILES

FC1=CC=C(N=C=S)C=C1C(F)(F)F

Other Names for this Substance

  • Benzene, 1-fluoro-4-isothiocyanato-2-(trifluoromethyl)-
  • 1-Fluoro-4-isothiocyanato-2-(trifluoromethyl)benzene
  • 1-Fluoro-2-trifluoromethyl-4-isothiocyanatobenzene

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