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1-Isothiocyanatooctadecane(CAS: 2877-26-1)

1-Isothiocyanatooctadecane
CAS Number

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Basic Information

Molecular Formula
C19H37NS
Molecular Weight
311.58 g/mol

Physical Properties

Melting Point
29-33 ºC

Chemical Identifiers

SMILES
CCCCCCCCCCCCCCCCCCN=C=S
InChIKey
VJIRSSFEIRFISD-UHFFFAOYSA-N

Database References

MDL Number
MFCD00041124

FAQ

1-Isothiocyanatooctadecane (CAS: 2877-26-1) is a solid at room temperature with a crystalline form. Its molecular weight is approximately 286 g/mol. It has limited solubility in common organic solvents like acetone and ethanol but is practically insoluble in water. Chemically, it is reactive, particularly towards nucleophiles and bases. It can undergo hydrolysis and substitution reactions.
1-Isothiocyanatooctadecane is typically synthesized through the reaction of 1-isonitrosooctadecane with hydrogen chloride followed by hydrolysis to form the isothiocyanate group. The reaction requires mild conditions and can be catalyzed by acids. The yield can be improved by optimizing the reaction parameters and using appropriate solvents.
1-Isothiocyanatooctadecane (CAS: 2877-26-1) is used in the pharmaceutical industry for the synthesis of certain drugs, particularly those requiring specific functional groups. It also finds applications in polymer synthesis, where its functional groups can be used to modify or cross-link polymers. Additionally, it is used in the development of sensors and semiconductors.
When handling 1-Isothiocyanatooctadecane (CAS: 2877-26-1), it is essential to wear appropriate personal protective equipment (PPE), including gloves, lab coat, and safety goggles. Ensure that all work is conducted in a well-ventilated fume hood to minimize exposure to toxic fumes. Spills should be cleaned up immediately using appropriate absorbents, and the area should be thoroughly washed down. Always refer to the Safety Data Sheet (SDS) for detailed information on handling, storage, and disposal.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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