CAS 4478-92-6
:(1-Isothiocyanatoethyl)benzene
Description:
(1-Isothiocyanatoethyl)benzene, also known by its CAS number 4478-92-6, is an organic compound characterized by the presence of both an isothiocyanate functional group and a benzene ring. This compound typically appears as a colorless to pale yellow liquid and has a distinctive, pungent odor associated with isothiocyanates. It is soluble in organic solvents but has limited solubility in water due to its hydrophobic benzene structure. The isothiocyanate group (-N=C=S) is known for its reactivity, particularly in nucleophilic substitution reactions, making this compound useful in various chemical syntheses and applications. Additionally, isothiocyanates are recognized for their biological activity, including potential anticancer properties. Safety considerations are important when handling this compound, as isothiocyanates can be irritants and may pose health risks if inhaled or ingested. Proper laboratory safety protocols should be followed to mitigate exposure. Overall, (1-Isothiocyanatoethyl)benzene serves as a valuable compound in both research and industrial applications.
Formula:C9H9NS
InChI:InChI=1S/C9H9NS/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3
InChI key:InChIKey=QQCJPTVZIZVKEZ-UHFFFAOYSA-N
SMILES:C(N=C=S)(C)C1=CC=CC=C1
Synonyms:- (+/-)-1-Phenylethyl isothiocyanate
- (1-Isothiocyanatoethyl)benzene
- Benzene, (1-isothiocyanatoethyl)-
- DL-alpha-Methylbenzyl isothiocyanate
- Isothiocyanic acid, α-methylbenzyl ester
- NSC 221236
- α-Methylbenzylisothiocyanate
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Found 3 products.
1-Phenylethyl isothiocyanate
CAS:Formula:C9H9NSPurity:98%Color and Shape:LiquidMolecular weight:163.23951-Phenylethyl isothiocyanate
CAS:<p>1-Phenylethyl isothiocyanate</p>Formula:C9H9NSPurity:98%Color and Shape: clear. yellow liquidMolecular weight:163.23945g/molDL-Methylbenzylisothiocyanate
CAS:Formula:C9H9NSPurity:98.0%Color and Shape:LiquidMolecular weight:163.24
