2-Chloroethyl N-(2,6-xylyl)carbamate

Base Information

• Chemical Name: 2-Chloroethyl N-(2,6-xylyl)carbamate
• CAS No.: 100129-63-3
• Molecular Formula: C₁₁H₁₄ClNO₂
• Molecular Weight: 227.691
• European Community (EC) Number: 665-783-9
• Mol file: 100129-63-3.mol

Synonyms:2-CHLOROETHYL N-(2,6-XYLYL)CARBAMATE;AKOS024335960

Chemical Property of 2-Chloroethyl N-(2,6-xylyl)carbamate

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 227.0713064
• Heavy Atom Count: 15
• Complexity: 201

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C)NC(=O)OCCCl

Technology Process of 2-Chloroethyl N-(2,6-xylyl)carbamate

There total 4 articles about 2-Chloroethyl N-(2,6-xylyl)carbamate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.5%

2-Chloroethyl chloroformate (627-11-2) + 2,6-dimethylaniline (87-62-7) → N-(2-chloroethoxycarbonyl)-2,6-dimethylaniline (100129-63-3)

Guidance literature:

With sodium hydroxide; In toluene; at 25 ℃; for 1.16667h;

DOI:10.1016/S0040-4039(00)80688-7

Reference yield:

2,6-dimethylaniline (87-62-7) → N-(2-chloroethoxycarbonyl)-2,6-dimethylaniline (100129-63-3)

Guidance literature:

Multi-step reaction with 3 steps

1: benzene

2: P₂O₅

3: toluene

With phosphorus pentoxide; toluene; benzene;

Reference yield:

ethyl 2,6-dimethylphenylcarbamate (35601-96-8) → N-(2-chloroethoxycarbonyl)-2,6-dimethylaniline (100129-63-3)

Guidance literature:

Multi-step reaction with 2 steps

1: P₂O₅

2: toluene

With phosphorus pentoxide; toluene;

upstream raw materials:

2,6-dimethylphenylisocyanate

2-chloro-ethanol

2-Chloroethyl chloroformate

2,6-dimethylaniline

Downstream raw materials:

(2-tert-Butoxy-ethyl)-(2,6-dimethyl-phenyl)-amine

N-(2'-n-Propoxyethyl)-2,6-xylidin

N-(2'-i-Propoxyethyl)-2,6-xylidin

2,6-dimethyl-N-(2'-methoxyethyl)-aniline

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