Methyl hydrazonothiocarbamate

Base Information

• Chemical Name: Methyl hydrazonothiocarbamate
• CAS No.: 44387-06-6
• Molecular Formula: C2H7N3S
• Molecular Weight: 105.164
• European Community (EC) Number: 665-407-3
• Mol file: 44387-06-6.mol

Synonyms:methyl hydrazonothiocarbamate;44387-06-6;methyl carbamohydrazonothioate;Methyl hydrazinecarbimidothioate hydroiodide;methylcarbamohydrazonothioate;NCIOpen2_005920;AKOS005362473;CS-0372142;{[amino(methylsulfanyl)methylidene]amino}amine;EN300-62651

Chemical Property of Methyl hydrazonothiocarbamate

Chemical Property:

• Melting Point: 136-137 °C
• Boiling Point: 166.2±23.0 °C(Predicted)
• PKA: 6.37±0.50(Predicted)
• PSA: 87.20000
• Density: 1.38±0.1 g/cm3(Predicted)
• LogP: 0.93840
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 105.03606841
• Heavy Atom Count: 6
• Complexity: 59.8

Purity/Quality:

98%min ^*data from raw suppliers

MethylHydrazonothiocarbamate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC(=NN)N
• Isomeric SMILES: CS/C(=N/N)/N

Technology Process of Methyl hydrazonothiocarbamate

There total 3 articles about Methyl hydrazonothiocarbamate 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: 96.0%

thiosemicarbazide (79-19-6) + methyl iodide (74-88-4) → methyl hydrazinecarbimidothioate (44387-06-6)

Guidance literature:

With ethanol; for 3h; Heating;

DOI:10.1016/j.tet.2007.05.112

Reference yield: 68.0%

thiosemicarbazide (79-19-6) + methyl iodide (74-88-4) → S‐methylthiosemicarbazide (44387-06-6)

Guidance literature:

In ethanol; at 20 ℃; for 21.75h; Reflux;

DOI:10.1007/s10534-013-9649-8

Reference yield:

→ methyl hydrazinecarbimidothioate (44387-06-6)

Guidance literature:

Thiosemicarbazid, CH3Cl;

upstream raw materials:

thiosemicarbazide

methyl iodide

Downstream raw materials:

C₁₁H₁₉N₅O

C₁₀H₁₄N₄S₂

C₉H₁₂N₄S₂

3-methylthio-5,6-bis(4-methoxyphenyl)-1,2,4-triazine

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