CAS 132740-45-5

2-(Isocyanatomethyl)-N,N-dimethylbenzenamine

Description:

2-(Isocyanatomethyl)-N,N-dimethylbenzenamine, with the CAS number 132740-45-5, is an organic compound characterized by the presence of both isocyanate and amine functional groups. This compound features a dimethylamino group attached to a benzene ring, which enhances its reactivity and solubility in organic solvents. The isocyanate group contributes to its potential as a versatile intermediate in organic synthesis, particularly in the production of polyurethanes and other polymers. The presence of the isocyanate functionality also indicates that this compound can participate in nucleophilic addition reactions, making it useful in various chemical applications. Additionally, the compound may exhibit toxicity and should be handled with care, as isocyanates are known to be irritants and sensitizers. Proper safety measures, including the use of personal protective equipment, are essential when working with this substance in a laboratory or industrial setting. Overall, its unique structure and functional groups make it a valuable compound in synthetic chemistry.

Formula: C₁₀H₁₂N₂O

InChI: InChI=1S/C10H12N2O/c1-12(2)10-6-4-3-5-9(10)7-11-8-13/h3-6H,7H2,1-2H3

InChI key: InChIKey=SQXTZPWCALQMES-UHFFFAOYSA-N

SMILES: C(N=C=O)C1=C(N(C)C)C=CC=C1

Synonyms:

• 2-(Isocyanatomethyl)-N,N-dimethylbenzenamine
• Benzenamine, 2-(isocyanatomethyl)-N,N-dimethyl-
• 2-(Isocyanatomethyl)-N,N-dimethylaniline