1-(4-methylphenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one

Base Information

• Chemical Name: 1-(4-methylphenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one
• CAS No.: 32607-35-5
• Molecular Formula: C10H10N2OS
• Molecular Weight: 206.268
• DSSTox Substance ID: DTXSID401250838
• Nikkaji Number: J788.665I
• Mol file: 32607-35-5.mol

Synonyms:1-(4-methylphenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one;32607-35-5;2-mercapto-3-(4-methylphenyl)-3,5-dihydro-4H-imidazol-4-one;3-p-Tolyl-2-thiohydantoin;3-(4-methylphenyl)-2-sulfanylideneimidazolidin-4-one;DTXSID401250838;STK317818;AKOS000348952;2-thioxo-3-(p-tolyl)imidazolidin-4-one;CS-0225188;EN300-12300;VU0047847-1;3-(4-Methylphenyl)-2-thioxo-4-imidazolidinone;3-(4-methylphenyl)-2-thioxoimidazolidin-4-one;SR-01000268208;SR-01000268208-1;Z85921192;F2739-0063

Chemical Property of 1-(4-methylphenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 206.05138412
• Heavy Atom Count: 14
• Complexity: 259

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)N2C(=O)CNC2=S

Technology Process of 1-(4-methylphenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one

There total 9 articles about 1-(4-methylphenyl)-2-sulfanyl-4,5-dihydro-1H-imidazol-5-one 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: 100.0%

ethyl 2‐(3‐(p‐tolyl)thioureido)acetate (111651-82-2) → 3-(4-methylphenyl)-2-thiohydantoin (32607-35-5)

Guidance literature:

With hydrogenchloride; In ethanol; Heating;

Reference yield: 92.0%

glycine (56-40-6,18875-39-3,25718-94-9) + 1-isothiocyanato-4-methylbenzene (622-59-3) → 3-(4-methylphenyl)-2-thiohydantoin (32607-35-5)

Guidance literature:

With sodium hydroxide; In pyridine; water; at 40 ℃; pH=9;

DOI:10.1016/S0008-6215(01)00040-4

Reference yield: 71.0%

tetra-p-tolyloxalic amidine (75390-40-8) + ethyl 2-isothiocyanatoacetate (24066-82-8) → 3-(4-methylphenyl)-2-thiohydantoin (32607-35-5) + {2-Thioxo-3-p-tolyl-4,5-bis-[(Z)-p-tolylimino]-imidazolidin-1-yl}-acetic acid ethyl ester (99006-58-3)

Guidance literature:

for 1h; Heating;

upstream raw materials:

N-p-Tolyl-N'-(carboxymethyl)thiourea

glycine

1-isothiocyanato-4-methylbenzene

ethyl 2‐(3‐(p‐tolyl)thioureido)acetate

Downstream raw materials:

1-acetyl-2-thioxo-3-p-tolyl-imidazolidin-4-one

5-naphthalen-1-ylmethylene-2-thioxo-3-p-tolyl-imidazolidin-4-one

3-p-Tolyl-5-(4'-nitrobenzyliden)-2-thio-hydantoin

5-(2-nitro-benzylidene)-2-thioxo-3-p-tolyl-imidazolidin-4-one

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