CAS 4426-83-9
:heptyl isothiocyanate
Description:
Heptyl isothiocyanate is an organic compound characterized by its isothiocyanate functional group attached to a heptyl chain. It is a colorless to pale yellow liquid with a pungent odor, typical of isothiocyanates, which are known for their distinctive and often strong smells. This compound is soluble in organic solvents but has limited solubility in water due to its hydrophobic heptyl chain. Heptyl isothiocyanate is primarily used in chemical synthesis and as a reagent in various organic reactions. It exhibits biological activity, including potential antimicrobial and insecticidal properties, making it of interest in agricultural and pharmaceutical applications. As with many isothiocyanates, it may also have implications in research related to cancer prevention and other health-related studies. Safety precautions should be observed when handling this compound, as it can be irritating to the skin and respiratory system. Proper storage in a cool, dry place away from incompatible substances is essential to maintain its stability and efficacy.
Formula:C8H15NS
InChI:InChI=1/C8H15NS/c1-2-3-4-5-6-7-9-8-10/h2-7H2,1H3
InChI key:InChIKey=LIPUQNPCPLDDBO-UHFFFAOYSA-N
SMILES:CCCCCCCN=C=S
Synonyms:- 1-Heptyl isothiocyanate
- 1-Isothiocyanatoheptane
- 3-Heptyl isothiocyanate
- Heptane, 1-isothiocyanato-
- Isothiocyanic acid, heptyl ester
- n-Heptyl isothiocyanate
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50
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90
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95
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100
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