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CAS 14214-31-4

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2-Chloro-3-isothiocyanato-1-propene

Description:
2-Chloro-3-isothiocyanato-1-propene, with the CAS number 14214-31-4, is an organic compound characterized by the presence of both a chloro group and an isothiocyanate functional group. This compound typically appears as a colorless to pale yellow liquid and has a pungent odor, which is common among isothiocyanates. It is known for its reactivity, particularly due to the presence of the isothiocyanate group, which can participate in nucleophilic reactions and is often used in organic synthesis. The chloro substituent enhances its electrophilic character, making it useful in various chemical transformations. Additionally, 2-Chloro-3-isothiocyanato-1-propene may exhibit biological activity, including potential herbicidal properties, which makes it of interest in agricultural chemistry. Safety precautions are necessary when handling this compound, as it may pose health risks through inhalation or skin contact. Overall, its unique structure and functional groups contribute to its utility in both synthetic and applied chemistry contexts.
Formula:C4H4ClNS
InChI:InChI=1S/C4H4ClNS/c1-4(5)2-6-3-7/h1-2H2
InChI key:InChIKey=DGBFPSVUFUDQNA-UHFFFAOYSA-N
SMILES:C(C(=C)Cl)N=C=S
Synonyms:
  • 1-Isothiocyanato-2-chloro-2-propene
  • 1-Propene, 2-chloro-3-isothiocyanato-
  • 2-Chloro Allyl Isothiocyanate
  • 2-Chloro-3-Isothiocyanatoprop-1-Enato(3-)
  • 2-Chloro-3-isothiocyanato-1-propene
  • 2-Chloroallyl isothiocyanate
  • 2-Chloroallylthioisocyanide
  • Isothiocyanic acid, 2-chloroallyl ester
  • β-Chloroallyl isothiocyanate
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