methyl 2-nitrobenzenesulfonate

Base Information

• Chemical Name: methyl 2-nitrobenzenesulfonate
• CAS No.: 30384-53-3
• Molecular Formula: C7H7 N O5 S
• Molecular Weight: 217.202
• Mol file: 30384-53-3.mol

Synonyms:Benzenesulfonicacid, o-nitro-, methyl ester (6CI,8CI); Methyl 2-nitrobenzenesulfonate; Methylo-nitrobenzenesulfonate

Chemical Property of methyl 2-nitrobenzenesulfonate

Chemical Property:

• Vapor Pressure: 3.39E-05mmHg at 25°C
• Melting Point: 60 °C
• Boiling Point: 365°Cat760mmHg
• Flash Point: 174.6°C
• PSA: 97.57000
• Density: 1.453g/cm³
• LogP: 2.53390
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Methanol (Slightly)

Purity/Quality:

Methyl2-Nitrobenzenesulfonate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: Methyl 2-Nitrobenzenesulfonate is an intermediate used in the synthesis of Sanguinarium-13CD3 Chloride (S112502). Sanguinarium-13CD3 Chloride is the labeled analogue of Sanguinarium Chloride (S112500). Sanguinarium Chloride is a natural product with antimicrobial, anti-inflammatory, and anti-oxidant properties.

Technology Process of methyl 2-nitrobenzenesulfonate

There total 3 articles about methyl 2-nitrobenzenesulfonate 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: 97.0%

sodium methylate (124-41-4) + 2-Nitrobenzenesulfonyl chloride (1694-92-4) → methyl 2-nitrobenzenesulfonate (30384-53-3)

Guidance literature:

In methanol; at 10 ℃; for 0.5h;

DOI:10.1021/jo9718758

Reference yield: 83.0%

methanol (67-56-1) + 2-Nitrobenzenesulfonyl chloride (1694-92-4) → methyl 2-nitrobenzenesulfonate (30384-53-3)

Guidance literature:

With sodium methylate; -15 degC to room temp.;

DOI:10.1021/jo00163a020

Reference yield:

→ methyl 2-nitrobenzenesulfonate (30384-53-3)

Guidance literature:

DOI:10.1007/BF00476156

upstream raw materials:

sodium methylate

2-Nitrobenzenesulfonyl chloride

methanol

Downstream raw materials:

1,2,4-trimethyl-thiazolo[5,4-b]pyridinediium; bis-(2-nitro-benzenesulfonate )

2-(4-dimethylamino-styryl)-1-methyl-4H-benzo[d][1,3]thiazinium; iodide

C₆H₄NO₅S^(1-)*C₂₈H₂₄NO₅⁽¹⁺⁾

nitidine chloride