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3-Chloropropyl Isocyanate(CAS: 13010-19-0)

3-Chloropropyl Isocyanate
CAS Number

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Basic Information

Molecular Formula
C4H6ClNO
Molecular Weight
119.55 g/mol

Physical Properties

Boiling Point
154°C(lit.)

Chemical Identifiers

SMILES
C(CN=C=O)CCl
InChIKey
RQAVSDINDRNIKL-UHFFFAOYSA-N

Database References

MDL Number
MFCD00010384
Beilstein Registry Number
1098789

FAQ

3-Chloropropyl Isocyanate (CAS: 13010-19-0) is a liquid at room temperature with a molecular weight of approximately 164.59 g/mol. It is slightly soluble in water but miscible with most organic solvents. It is highly reactive due to the isocyanate group, making it prone to various polymerization reactions and addition reactions.
3-Chloropropyl Isocyanate is typically synthesized via the reaction of chloropropane with phosgene in the presence of a Lewis acid catalyst. The process yields a high conversion rate and is known for its mild conditions and good selectivity.
3-Chloropropyl Isocyanate is widely used in the pharmaceutical industry for the synthesis of active pharmaceutical ingredients, in the polymer industry for making special polyurethane materials, and in sensors for detecting various gases.
When handling 3-Chloropropyl Isocyanate, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a respirator. Work should be conducted in a well-ventilated area or a fume hood. Spills should be handled carefully, and the material safety data sheet (MSDS) should be consulted for specific handling procedures.

Safety Notice

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

Always follow proper handling procedures