Dipropylcarbamoyl chloride

Base Information

• Chemical Name: Dipropylcarbamoyl chloride
• CAS No.: 27086-19-7
• Molecular Formula: C7H14 Cl N O
• Molecular Weight: 163.647
• Hs Code.: 2903199000
• European Community (EC) Number: 248-217-1
• DSSTox Substance ID: DTXSID30181553
• Nikkaji Number: J308.445K
• Wikidata: Q83052183
• Mol file: 27086-19-7.mol

Synonyms:Dipropylcarbamoyl chloride;27086-19-7;N,N-Dipropylcarbamoyl chloride;n,n-di-n-propylcarbamoyl chloride;EINECS 248-217-1;Dipropylcarbamic chloride;N,N-Dipropylcarbamoylchloride;SCHEMBL856638;DTXSID30181553;OWRABTHGOKNUDV-UHFFFAOYSA-N;AKOS016347334;EN300-1265388;F0001-0880

Chemical Property of Dipropylcarbamoyl chloride

Chemical Property:

• Vapor Pressure: 0.084mmHg at 25°C
• Boiling Point: 226°Cat760mmHg
• Flash Point: 90.5°C
• PSA: 20.31000
• Density: 1.023g/cm³
• LogP: 2.46720
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 163.0763918
• Heavy Atom Count: 10
• Complexity: 99.8

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN(CCC)C(=O)Cl

Technology Process of Dipropylcarbamoyl chloride

There total 15 articles about Dipropylcarbamoyl 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: 100.0%

S-methyl N,N-di-n-propylthiocarbamate (55852-80-7) → N,N-dipropylcarbamoyl chloride (27086-19-7)

Guidance literature:

With sulfuryl dichloride; at 0 - 20 ℃; for 1h;

DOI:10.1016/S0040-4020(03)00031-0

Reference yield: 92.65%

tetrapropyl thiuram disulfide (2556-42-5) → N,N-dipropylcarbamoyl chloride (27086-19-7)

Guidance literature:

tetrapropyl thiuram disulfide; With chlorine; In dichloromethane; at 24 - 26 ℃; for 6.83333h; Cooling with ice;

With water; sodium hydrogencarbonate; In dichloromethane; Cooling with ice;

DOI:10.1080/00397910903537331

Reference yield: 92.0%

bis(trichloromethyl) carbonate (32315-10-9) + di-n-propylamine (142-84-7) → N,N-dipropylcarbamoyl chloride (27086-19-7)

Guidance literature:

With sodium hydroxide; for 0.0333333h; Neat (no solvent);

DOI:10.1016/j.cclet.2012.06.025

upstream raw materials:

dipropyl-aminooxalyl chloride

di-n-propylamine

ethyl N,N-dipropylcarbamate

phosgene

Downstream raw materials:

N-nitroso-N,N-dipropylamine

N-nitrodipropylamine

dipropylammonium nitrate

N'-{[1-(4-fluorophenyl)-1H-indazol-5-yl]methyl}-N,N-dipropylurea

Refernces

• 1、 Huang, Mei-Yan,Lin, Jing,Huang, Zhi-Jian,Xu, Hong-Gui,Hong, Juan,Sun, Ping-Hua,Guo, Jia-Liang,Chen, Wei-Min. "Design, synthesis and anti-inflammatory effects of novel 9-O-substituted-berberine derivatives". . p. 658 - 666. Retrieved 2016/05/19.
• 2、 Adeppa,Rupainwar,Misra, Krishna. "Development of an improved method for conversion of thiuram disulfides into N,N-dialkylcarbamoyl halides and derivatives". experimental part. p. 285 - 290. Retrieved 2011/03/20.