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CAS 89007-45-4

:

4-Isopropylphenyl isothiocyanate

Description:
4-Isopropylphenyl isothiocyanate, with the CAS number 89007-45-4, is an organic compound characterized by the presence of an isothiocyanate functional group attached to a phenyl ring that has an isopropyl substituent. This compound typically appears as a colorless to pale yellow liquid and has a distinctive pungent odor, characteristic of isothiocyanates. It is known for its reactivity, particularly in nucleophilic substitution reactions, and can act as a potent electrophile due to the presence of the isothiocyanate group. 4-Isopropylphenyl isothiocyanate is often studied for its potential biological activities, including antimicrobial and anticancer properties, making it of interest in pharmaceutical and agricultural research. Additionally, it is soluble in organic solvents but has limited solubility in water. Safety precautions should be taken when handling this compound, as isothiocyanates can be irritants and may pose health risks upon exposure.
Formula:C10H11NS
InChI:InChI=1/C10H11NS/c1-8(2)9-3-5-10(6-4-9)11-7-12/h3-6,8H,1-2H3
SMILES:CC(C)c1ccc(cc1)N=C=S
Synonyms:
  • 1-Isothiocyanato-4-(Propan-2-Yl)Benzene
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