Methyl N,N,N'-trimethylcarbamimidothioate

Base Information

• Chemical Name: Methyl N,N,N'-trimethylcarbamimidothioate
• CAS No.: 61713-37-9
• Molecular Formula: C5H12N2S
• Molecular Weight: 132.22718
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID10497023
• Nikkaji Number: J3.335.484C
• Mol file: 61713-37-9.mol

Synonyms:61713-37-9;Methyl N,N,N'-trimethylcarbamimidothioate;Tetramethylpseudothioharnstoff;SCHEMBL1138035;SCHEMBL8704014;DTXSID10497023

Chemical Property of Methyl N,N,N'-trimethylcarbamimidothioate

Chemical Property:

• PSA: 40.90000
• LogP: 0.89680
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 132.07211956
• Heavy Atom Count: 8
• Complexity: 88.4

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN=C(N(C)C)SC

Technology Process of Methyl N,N,N'-trimethylcarbamimidothioate

There total 1 articles about Methyl N,N,N'-trimethylcarbamimidothioate 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:

1,1,3-trimethylthiourea (2489-77-2) + dimethyl sulfate (77-78-1) → tetramethyl-isothiourea (61713-37-9)

Guidance literature:

With water; Das methylschwefelsaure Salz entsteht;

Reference yield:

tetramethyl-isothiourea (61713-37-9) → C13H20N3O3S2(1+)*ClO4(1-)

Guidance literature:

Multi-step reaction with 2 steps

2: HClO₄, Ac₂O / acetonitrile

With perchloric acid; acetic anhydride; In acetonitrile;

Reference yield:

tetramethyl-isothiourea (61713-37-9) → C14H22N3O4S2(1+)*ClO4(1-)

Guidance literature:

Multi-step reaction with 2 steps

2: HClO₄, Ac₂O / acetonitrile

With perchloric acid; acetic anhydride; In acetonitrile;

upstream raw materials:

1,1,3-trimethylthiourea

dimethyl sulfate

Downstream raw materials:

N,N,N',N',N-pentamethylguanidine

N,N,N',N',S-pentamethylthiuronium iodide

N-(p-toluenesulfonyl)-N',N',S-trimethylisothiourea

C₁₃H₁₉N₃O₃S₂