Ethyl(phenyl)carbamoyl chloride

Base Information

• Chemical Name: Ethyl(phenyl)carbamoyl chloride
• CAS No.: 33758-39-3
• Molecular Formula: C9H10 Cl N O
• Molecular Weight: 183.637
• Hs Code.: 2903999090
• European Community (EC) Number: 251-670-8
• NSC Number: 71238
• UNII: 33BGY95BXH
• DSSTox Substance ID: DTXSID00187426
• Nikkaji Number: J308.536H
• Wikidata: Q83059131
• Mol file: 33758-39-3.mol

Synonyms:N-ethyl-N-phenylcarbamoyl chloride;33758-39-3;Ethyl(phenyl)carbamoyl chloride;ethyl(phenyl)carbamic chloride;EINECS 251-670-8;Ethylphenylcarbamoyl chloride;33BGY95BXH;Carbamic chloride, ethylphenyl-;NSC-71238;UNII-33BGY95BXH;ethyl(phenyl)carbamicchloride;NCIOpen2_000570;SCHEMBL5481370;Ethylphenylcarbamic acid chloride;DTXSID00187426;NSC71238;NSC 71238;AKOS006328133;CARBANILOYL CHLORIDE, N-ETHYL-;N-ETHYL-N-PHENYLCARBAMIC CHLORIDE;CARBAMIC CHLORIDE, N-ETHYL-N-PHENYL-;EN300-1244206

Chemical Property of Ethyl(phenyl)carbamoyl chloride

Chemical Property:

• Vapor Pressure: 0.00164mmHg at 25°C
• Boiling Point: 294.2°Cat760mmHg
• Flash Point: 131.7°C
• PSA: 20.31000
• Density: 1.204g/cm³
• LogP: 2.87170
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 183.0450916
• Heavy Atom Count: 12
• Complexity: 155

Purity/Quality:

99% ^*data from raw suppliers

KH000558:ETHYL(PHENYL)CARBAMOYLCHLORIDE 96 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(C1=CC=CC=C1)C(=O)Cl

Technology Process of Ethyl(phenyl)carbamoyl chloride

There total 4 articles about Ethyl(phenyl)carbamoyl chloride 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: 98.0%

bis(trichloromethyl) carbonate (32315-10-9) + N-ethyl-N-phenylamine (103-69-5) → N-ethyl-N-phenyl carbamoyl chloride (33758-39-3)

Guidance literature:

With sodium hydroxide; for 0.0833333h; Neat (no solvent);

DOI:10.1016/j.cclet.2012.06.025

Reference yield:

phosgene (75-44-5) + N-ethyl-N-phenylamine (103-69-5) → N-ethyl-N-phenyl carbamoyl chloride (33758-39-3)

Guidance literature:

With aqueous alkali;

Reference yield:

phosgene (75-44-5) + chloroform (67-66-3,8013-54-5) + N-ethyl-N-phenylamine (103-69-5) → N-ethyl-N-phenyl carbamoyl chloride (33758-39-3)

Guidance literature:

upstream raw materials:

phosgene

chloroform

N-ethyl-N-phenylamine

bis(trichloromethyl) carbonate

Downstream raw materials:

ethyl centralite

ethyl-phenyl-carbamic acid-(2-nitro-phenyl ester)

4-[2-(3-Ethyl-3-phenyl-ureido)-ethyl]-benzenesulfonamide

N-ethylbenzimidazolinone

Refernces

• 1、 Ivanovich, Ryan A.,Polat, Dilan E.,Beauchemin, André M.. "Photocatalytic Intramolecular C-H Amination Using N-Oxyureas as Nitrene Precursors". supporting information. p. 6360 - 6364. Retrieved 2020/09/02.
• 2、 Zare, Hassan,Ghanbari, Mohammad Mehdi,Jamali, Marzieh,Aboodi, Abdollah. "A novel and efficient strategy for the synthesis of various carbamates using carbamoyl chlorides under solvent-free and grinding conditions using microwave irradiation". scheme or table. p. 883 - 886. Retrieved 2012/08/28.