Ethyl 2-fluoro-5-isothiocyanatobenzoate

CAS Registry Number®

1027513-55-8
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CAS Name

Ethyl 2-fluoro-5-isothiocyanatobenzoate

Molecular Formula

C10H8FNO2S

Molecular Mass

225.24

Cite this Page

Ethyl 2-fluoro-5-isothiocyanatobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1027513-55-8 (retrieved 2024-08-28) (CAS RN: 1027513-55-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H8FNO2S/c1-2-14-10(13)8-5-7(12-6-15)3-4-9(8)11/h3-5H,2H2,1H3

InChIKey

InChIKey=SXGDSVLEAUARBP-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=CC(N=C=S)=CC=C1F

Canonical SMILES

O=C(OCC)C1=CC(N=C=S)=CC=C1F

Other Names for this Substance

  • Benzoic acid, 2-fluoro-5-isothiocyanato-, ethyl ester
  • Ethyl 2-fluoro-5-isothiocyanatobenzoate