5,5-Dimethyl-3-(methylamino)cyclohex-2-ene-1-thione

Base Information

• Chemical Name: 5,5-Dimethyl-3-(methylamino)cyclohex-2-ene-1-thione
• CAS No.: 70133-98-1
• Molecular Formula: C9H15NS
• Molecular Weight: 169.291
• DSSTox Substance ID: DTXSID10499466
• Wikidata: Q82350260

Synonyms:5,5-Dimethyl-3-(methylamino)cyclohex-2-ene-1-thione;70133-98-1;DTXSID10499466

Chemical Property of 5,5-Dimethyl-3-(methylamino)cyclohex-2-ene-1-thione

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 169.09252066
• Heavy Atom Count: 11
• Complexity: 204

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(CC(=CC(=S)C1)NC)C

Technology Process of 5,5-Dimethyl-3-(methylamino)cyclohex-2-ene-1-thione

There total 5 articles about 5,5-Dimethyl-3-(methylamino)cyclohex-2-ene-1-thione 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: 48.0%

5,5-dimethyl-3-methylamino-2-cyclohexenone (701-58-6) → 5,5-Dimethyl-3-amino-2-cyclohexenthion (70133-98-1)

Guidance literature:

With Lawessons reagent; In 1,2-dimethoxyethane;

Reference yield:

N-(3-methoxy-5,5-dimethyl-2-cyclohexen-1-ylidene)pyrrolidinium iodide (80371-87-5) → 5,5-Dimethyl-3-amino-2-cyclohexenthion (70133-98-1)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂S / -60 - -40 °C

2: 20 °C

With hydrogen sulfide;

Reference yield:

N-(5,5-Dimethyl-3-methoxy-cyclohex-2-en-1-yliden)-morpholinium (70134-11-1) → 5,5-Dimethyl-3-amino-2-cyclohexenthion (70133-98-1)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂S / -60 - -40 °C

2: 20 °C

With hydrogen sulfide;

upstream raw materials:

5,5-dimethyl-3-methylamino-2-cyclohexenone

3-Methoxy-5,5-dimethyl-2-cyclohexene-1-thione

methylamine

N-(3-methoxy-5,5-dimethyl-2-cyclohexen-1-ylidene)pyrrolidinium iodide

Downstream raw materials:

5,5-Dimethyl-3-methylamino-2-(1-pyrrolidinylmethyl)-2-cyclohexen-1-thion

2-Dimethylaminomethyl-5,5-dimethyl-3-methylamino-2-cyclohexen-1-thion

2-Diethylaminomethyl-5,5-dimethyl-3-methylamino-2-cyclohexen-1-thion

2-(5,5-Dimethyl-3-oxo-cyclohex-1-enyl)-3-mercapto-2-methyl-propionic acid methyl ester

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