4-(3-Methyl-2-oxo-imidazolidin-1-yl)-benzenesulfonyl chloride

Base Information

• Chemical Name: 4-(3-Methyl-2-oxo-imidazolidin-1-yl)-benzenesulfonyl chloride
• CAS No.: 392691-83-7
• Molecular Formula: C₁₀H₁₁ClN₂O₃S
• Molecular Weight: 274.728
• DSSTox Substance ID: DTXSID301188969
• Mol file: 392691-83-7.mol

Synonyms:SCHEMBL2234811;OJFMRTLIZKJHBS-UHFFFAOYSA-N;DTXSID301188969;4-(3-methyl-2-oxo-imidazolidin-1-yl)-benzenesulfonyl chloride;392691-83-7;4-(3-Methyl-2-oxo-1-imidazolidinyl)benzenesulfonyl chloride;4-(3-methyl-2-oxo-imidazolidin-1-yl) -benzenesulfonyl chloride

Chemical Property of 4-(3-Methyl-2-oxo-imidazolidin-1-yl)-benzenesulfonyl chloride

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 274.0178911
• Heavy Atom Count: 17
• Complexity: 398

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1CCN(C1=O)C2=CC=C(C=C2)S(=O)(=O)Cl

Technology Process of 4-(3-Methyl-2-oxo-imidazolidin-1-yl)-benzenesulfonyl chloride

There total 6 articles about 4-(3-Methyl-2-oxo-imidazolidin-1-yl)-benzenesulfonyl chloride 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: 76.0%

4,5-dihydro-3-methyl-1-phenylimidazol-2(1H)-one (3363-68-6) → 4-(3-methyl-2-oxoimidazolidin-1-yl)benzene-1-sulfonyl chloride (392691-83-7)

Guidance literature:

With chlorosulfonic acid; In tetrachloromethane; at 0 ℃; for 2h;

Reference yield:

3-methyl-1-phenylimidazol-2(1H)-one (1201-15-6) → 4-(3-methyl-2-oxoimidazolidin-1-yl)benzene-1-sulfonyl chloride (392691-83-7)

Guidance literature:

In chlorosulfonic acid;

Reference yield:

1-phenylimidazolidin-2-one (1848-69-7) → 4-(3-methyl-2-oxoimidazolidin-1-yl)benzene-1-sulfonyl chloride (392691-83-7)

Guidance literature:

Multi-step reaction with 2 steps

1: NaH / dimethylformamide

2: HOSO₂Cl / 60 °C

With chlorosulfonic acid; sodium hydride; In N,N-dimethyl-formamide;

DOI:10.1016/S0960-894X(99)00072-4

upstream raw materials:

4,5-dihydro-3-methyl-1-phenylimidazol-2(1H)-one

1-phenylimidazolidin-2-one

3-methyl-1-phenylimidazol-2(1H)-one

N-(2-aminoethyl)benzeneamine

Downstream raw materials:

2-tolyl 4-(3-methyl-2-oxoimidazolidin-1-yl)benzenesulfonate

2-ethylphenyl 4-(3-methyl-2-oxoimidazolidin-1-yl)benzenesulfonate

2,4-dimethylphenyl 4-(3-methyl-2-oxoimidazolidin-1-yl)benzenesulfonate

2,4,5-trichlorophenyl 4-(3-methyl-2-oxoimidazolidin-1-yl)benzenesulfonate