Methylaminoformyl chloride

Base Information

• Chemical Name: Methylaminoformyl chloride
• CAS No.: 6452-47-7
• Molecular Formula: C2H4ClNO
• Molecular Weight: 93.5129
• European Community (EC) Number: 229-253-7
• NSC Number: 133003
• DSSTox Substance ID: DTXSID60214787
• Nikkaji Number: J23.393E
• Wikidata: Q72486958
• Mol file: 6452-47-7.mol

Synonyms:Methylaminoformyl chloride;6452-47-7;methylcarbamic chloride;N-methylcarbamoyl chloride;Methylcarbamoyl chloride;N-Methylaminoformyl chloride;Methylcarbamoylchloride;EINECS 229-253-7;MFCD08703300;NSC 133003;methylcarbamicchloride;methylcarbamyl chloride;Methylaminoformylchloride;N-Methylcarbamic chloride;Carbamic chloride, methyl-;Carbamic chloride, N-methyl-;DTXSID60214787;BCP25845;BBL100379;NSC133003;STL554173;AKOS006228898;methylaminoformyl chloride, AldrichCPR;NSC-133003;BB 0262863;FT-0636154;EN300-69705;D81983;J-522691

Chemical Property of Methylaminoformyl chloride

Chemical Property:

• Appearance/Colour: white crystals
• Melting Point: 45 °C
• Refractive Index: 1.415
• Boiling Point: 93oC (dec.)
• PKA: 10.67±0.46(Predicted)
• PSA: 29.10000
• Density: 1.185 g/cm³
• LogP: 0.95550
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: Acetonitrile, Chloroform (Slightly), DMSO
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 92.9981414
• Heavy Atom Count: 5
• Complexity: 44.9

Purity/Quality:

98%,99%, ^*data from raw suppliers

MethylcarbamoylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC(=O)Cl
• Description: Methylcarbamoyl Chloride is used as a reagent in the synthesis of acylprolinamides as a new class of peptide deformylase inhibitors with in vivo antibacterial activity. Methylcarbamoyl Chloride is also used as a reagent in the synthesis of carbamate derivatives as potential dual-binding site acetylcholinesterase inhibitors. The decomposition tail gas hydrogen chloride of Methylaminoformyl chloride is also useful during the cartap synthesis.
• Uses: Methylaminoformyl chloride can be widely used as an intermediate of carbamate insecticides such as Zhongdingwei, carbofuran, isoprocarb, methomyl, chlorhexidine and carbaryl. Methylaminoformyl chloride is also used as a reagent in the synthesis of carbamate derivatives as potential dual-binding site acetylcholinesterase inhibitors. The decomposition tail gas hydrogen chloride of Methylaminoformyl chloride is also useful during the cartap synthesis. Methylcarbamoyl Chloride is used as a reagent in the synthesis of acylprolinamides as a new class of peptide deformylase inhibitors with in vivo antibacterial activity. Methylcarbamoyl Chloride is also used as a reagent in the synthesis of carbamate derivatives as potential dual-binding site acetylcholinesterase inhibitors.

Technology Process of Methylaminoformyl chloride

There total 7 articles about Methylaminoformyl 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: 96.7%

methycarbamoyl chloride + 1,1-Dimethylurea (598-94-7) + methyl isocyanate (624-83-9) → methylcarbamoyl chloride (6452-47-7)

Guidance literature:

In chloroform;

Reference yield: 90.0%

→ methylcarbamoyl chloride (6452-47-7)

Guidance literature:

Reference yield: 77.3%

Ethyl N-methylcarbamate (105-40-8) → methyl isocyanate (624-83-9) + methylcarbamoyl chloride (6452-47-7)

Guidance literature:

With Phenyltrichlorosilane; at 100 - 150 ℃; for 1h;

upstream raw materials:

phosgene

methylamine hydrochloride

methylamine

methyl isocyanate

Downstream raw materials:

5-amino-N₁-methyl-1H-imidazole-1,4-dicarboxamide

carbonic-acid

methylamine hydrochloride

hydrogenchloride

Refernces

• 1、 Artuso, Emma,Degani, Iacopo,Fochi, Rita,Magistris, Claudio. "One-pot, three-step preparation of alkyl and aryl alkylcarbamates from S-methyl N-alkylthiocarbamates". experimental part. p. 1612 - 1618. Retrieved 2009/04/03.
• 2、 D'Silva, Themistocles D. J.,Lopes, Anibal,Jones, Russell L.,Singhawangcha, Sureerat,Chan, John K.. "Studies of Methyl Isocyanate Chemistry in the Bhopal Incident". . p. 3781 - 3788. Retrieved 2007/10/02.