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1-(Chloromethyl)-2-isocyanatobenzene(CAS: 52986-66-0)

1-(Chloromethyl)-2-isocyanatobenzene
CAS Number

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Basic Information

Molecular Formula
C8H6ClNO
Molecular Weight
167.59 g/mol

Physical Properties

Boiling Point
45-47 °C/0.2 mmHg(lit.)
Density
1.241 g/mL at 25 °C(lit.)

Chemical Identifiers

SMILES
C1=CC=C(C(=C1)CCl)N=C=O
InChIKey
XTYOTPBIDRGAML-UHFFFAOYSA-N

Database References

MDL Number
MFCD00077427
Beilstein Registry Number
957161

FAQ

1-(Chloromethyl)-2-isocyanatobenzene (CAS 52986-66-0) is subject to various regulatory guidelines, including GHS classification, which categorizes it as a flammable liquid and a skin and eye irritant. It is also regulated under REACH in the European Union, requiring registration for substances above 1 tonne annually. FDA and EPA regulations may apply for its use in pharmaceuticals and environmental applications, respectively, requiring proper handling, storage, and disposal to prevent environmental contamination and ensure worker safety.
There are several alternatives to 1-(Chloromethyl)-2-isocyanatobenzene (CAS 52986-66-0) in synthesis, including isomers such as 1-chloro-2-(isocyanatomethyl)benzene and 2-chloro-1-(isocyanatomethyl)benzene, as well as other isocyanate derivatives. Common alternative reagents include 1-(bromomethyl)-2-isocyanatobenzene and 1-(trifluoromethyl)-2-isocyanatobenzene, which can serve similar functional groups in various chemical reactions.
The market for 1-(Chloromethyl)-2-isocyanatobenzene (CAS 52986-66-0) is relatively niche, with increasing research trends in its use as a monomer for polymer synthesis and as a precursor in the production of pharmaceuticals and materials with specific functional groups. The demand is influenced by the development of new applications and the need for safer, more environmentally friendly alternatives to traditional isocyanates. Price trends are stable but may fluctuate based on supply chain disruptions and changes in regulatory landscape.
Waste containing 1-(Chloromethyl)-2-isocyanatobenzene (CAS 52986-66-0) should be managed carefully to prevent environmental contamination and ensure worker safety. Collection should be done in compatible containers, and the waste should be disposed of through incineration or professional waste disposal services that comply with local regulations. Environmental protection precautions include proper containment, neutralization of any acidic or basic components, and adherence to guidelines outlined by organizations such as the EPA and OSHA to minimize exposure risks and protect the environment.

Safety Notice

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

Always follow proper handling procedures

Contact Information

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shenlinxing@macklin.cn

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021-50706066

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