5-Ethyl-2-methoxybenzene-1-sulfonyl chloride

Base Information

• Chemical Name: 5-Ethyl-2-methoxybenzene-1-sulfonyl chloride
• CAS No.: 88040-88-4
• Molecular Formula: C9H11 Cl O3 S
• Molecular Weight: 234.704
• Hs Code.: 2909309090
• European Community (EC) Number: 673-474-5
• DSSTox Substance ID: DTXSID00374531
• Wikidata: Q82163150
• Mol file: 88040-88-4.mol

Synonyms:88040-88-4;5-ethyl-2-methoxybenzene-1-sulfonyl chloride;5-ethyl-2-methoxy-benzenesulfonyl Chloride;5-ethyl-2-methoxybenzenesulfonyl chloride;MFCD03424997;SCHEMBL741235;DTXSID00374531;AB1434;AKOS005139309;5-Ethyl-2-methoxybenzenesulfonylchloride;5-ethyl-2-methoxyphenylsulfonyl chloride;AS-44579;5-ethyl-2-methoxybenzene-1-sulfonylchloride;CS-0146445;FT-0715244;A842447

Chemical Property of 5-Ethyl-2-methoxybenzene-1-sulfonyl chloride

Chemical Property:

• PSA: 51.75000
• LogP: 3.26590
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: Dichloromethane (Slightly)
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 234.0117431
• Heavy Atom Count: 14
• Complexity: 270

Purity/Quality:

97% ^*data from raw suppliers

5-Ethyl-2-methoxybenzene-1-sulfonylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 43
• Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=C(C=C1)OC)S(=O)(=O)Cl

Technology Process of 5-Ethyl-2-methoxybenzene-1-sulfonyl chloride

There total 3 articles about 5-Ethyl-2-methoxybenzene-1-sulfonyl 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: 53.0%

p-ethylanisole (1515-95-3) → 5-ethyl-2-methoxybenzene sulfonyl chloride (88040-88-4)

Guidance literature:

With chlorosulfonic acid; at 0 - 20 ℃; for 2h;

Reference yield:

4-Ethylphenol (123-07-9) → 5-ethyl-2-methoxybenzene sulfonyl chloride (88040-88-4)

Guidance literature:

Multi-step reaction with 2 steps

1: K₂CO₃ / acetone

2: ClSO₃H / 3 h / Ambient temperature

With chlorosulfonic acid; potassium carbonate; In acetone;

DOI:10.1016/S0040-4020(97)00134-8

Reference yield:

→ 5-ethyl-2-methoxybenzene sulfonyl chloride (88040-88-4)

Guidance literature:

4-Ethyl-anisol, Chlorsulfurierung nach Stewart;

upstream raw materials:

p-ethylanisole

4-Ethylphenol

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