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CAS 19241-20-4

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Benzene, 1-ethyl-3-isothiocyanato-

Description:
Benzene, 1-ethyl-3-isothiocyanato- (CAS 19241-20-4) is an organic compound characterized by its aromatic benzene ring substituted with an ethyl group and an isothiocyanate functional group. The presence of the isothiocyanate group (-N=C=S) imparts unique reactivity, making it a valuable intermediate in organic synthesis, particularly in the production of various pharmaceuticals and agrochemicals. This compound typically exhibits a colorless to pale yellow liquid form with a distinctive odor. It is known for its moderate volatility and relatively low solubility in water, while being more soluble in organic solvents. The isothiocyanate moiety contributes to its potential biological activity, including antimicrobial and anticancer properties. However, it is important to handle this compound with care due to its potential toxicity and irritant effects on the skin and respiratory system. Proper safety measures should be observed when working with this substance in laboratory or industrial settings.
Formula:C9H9NS
InChI:InChI=1S/C9H9NS/c1-2-8-4-3-5-9(6-8)10-7-11/h3-6H,2H2,1H3
InChI key:InChIKey=FRMFJQIVPNSSPX-UHFFFAOYSA-N
SMILES:N(=C=S)C1=CC(CC)=CC=C1
Synonyms:
  • 1-Ethyl-3-isothiocyanatobenzene
  • 2-(Methoxymethyl)Tetrahydrofuran
  • Benzene, 1-ethyl-3-isothiocyanato-
  • Isothiocyanic acid, m-ethylphenyl ester
  • 3-Ethylphenyl isothiocyanate
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