1,3-Benzothiazole-2-carbothiohydrazide

Base Information

• Chemical Name: 1,3-Benzothiazole-2-carbothiohydrazide
• CAS No.: 127627-23-0
• Molecular Formula: C₈H₇N₃S₂
• Molecular Weight: 209.296
• DSSTox Substance ID: DTXSID40562975
• Wikidata: Q82447314
• Mol file: 127627-23-0.mol

Synonyms:1,3-Benzothiazole-2-carbothiohydrazide;127627-23-0;2-Benzothiazolecarbothioicacid,hydrazide(9CI);DTXSID40562975

Chemical Property of 1,3-Benzothiazole-2-carbothiohydrazide

Chemical Property:

• PSA: 111.27000
• LogP: 2.52630
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 209.00813958
• Heavy Atom Count: 13
• Complexity: 210

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)C(=S)NN

Technology Process of 1,3-Benzothiazole-2-carbothiohydrazide

There total 1 articles about 1,3-Benzothiazole-2-carbothiohydrazide 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: 75.0%

benzothiazole-2-dithiocarboxylate methyl ester (92081-75-9) → benzothiazole-2 carbothiohydrazide (127627-23-0)

Guidance literature:

With hydrazine hydrate; In ethanol; at 30 - 40 ℃;

upstream raw materials:

benzothiazole-2-dithiocarboxylate methyl ester