4-Chlorophenyl carbamate

Base Information

• Chemical Name: 4-Chlorophenyl carbamate
• CAS No.: 5724-99-2
• Molecular Formula: C7H6ClNO2
• Molecular Weight: 171.583
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID90431445
• Nikkaji Number: J307.678D
• Wikidata: Q82245324
• Mol file: 5724-99-2.mol

Synonyms:4-chlorophenyl carbamate;5724-99-2;SCHEMBL81261;DTXSID90431445;Carbamic acid 4-chlorophenyl ester

Chemical Property of 4-Chlorophenyl carbamate

Chemical Property:

• PSA: 53.31000
• LogP: 2.31130
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 171.0087061
• Heavy Atom Count: 11
• Complexity: 143

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1OC(=O)N)Cl

Technology Process of 4-Chlorophenyl carbamate

There total 9 articles about 4-Chlorophenyl 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: 70.0%

potassium cyanate (590-28-3) + 4-chloro-phenol (106-48-9,82344-39-6) → O-p-Chlorophenylcarbamate (5724-99-2)

Guidance literature:

With para-dodecylbenzenesulfonic acid; In neat (no solvent); at 60 ℃; for 1h; Green chemistry;

DOI:10.1039/c5ra14528g

Reference yield: 66.0%

4-chloro-phenol (106-48-9,82344-39-6) + urea (57-13-6) → O-p-Chlorophenylcarbamate (5724-99-2)

Guidance literature:

With choline chloride; tin(ll) chloride; at 130 ℃; for 8h; Green chemistry;

DOI:10.1039/d1nj01827b

Reference yield: 45.0%

4-chloro-phenol (106-48-9,82344-39-6) → O-p-Chlorophenylcarbamate (5724-99-2)

Guidance literature:

upstream raw materials:

4-chlorophenyl chlorothionoformate

N,N'-Bis-<4-chlor-phenoxycarbimidoyl>-benzolsulfonsaeure-hydrazid

sodium isocyanate

4-chloro-phenol

Downstream raw materials:

N.N'-Methylen-bis-

N.N'-Ethyliden-bis-

5-chloro-2-benzoxazolinone

pentyl carbamate

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