(S)-Glycidyl 3-nitrobenzenesulfonate

Base Information

• Chemical Name: (S)-Glycidyl 3-nitrobenzenesulfonate
• CAS No.: 115314-14-2
• Molecular Formula: C9H9NO6S
• Molecular Weight: 259.24
• Hs Code.: 29209090
• European Community (EC) Number: 621-475-6
• UNII: TH53HZU4D9
• DSSTox Substance ID: DTXSID00151046
• Nikkaji Number: J534.800E
• Wikidata: Q72480682
• Mol file: 115314-14-2.mol

Synonyms:glycidyl 3-NBS;glycidyl 3-nitrobenzenesulfonate

Chemical Property of (S)-Glycidyl 3-nitrobenzenesulfonate

Chemical Property:

• Appearance/Colour: White crystalline powder
• Vapor Pressure: 2.86E-07mmHg at 25°C
• Melting Point: 61-65 ºC
• Refractive Index: 1.585
• Boiling Point: 432.2 ºC at 760 mmHg
• Flash Point: 215.2ºC
• PSA: 110.10000
• Density: 1.527 g/cm³
• LogP: 2.30290
• Storage Temp.: -20°C
• Sensitive.: Moisture Sensitive
• Solubility.: Soluble in chloroform, methylene chloride and tetrahydrofuran. I
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 259.01505818
• Heavy Atom Count: 17
• Complexity: 383

Purity/Quality:

98% MIN ^*data from raw suppliers

(S)-(+)-GlycidylNosylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-5
• Safety Statements: 37/39-26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]
• Isomeric SMILES: C1[C@H](O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]
• Uses: (S)-(+)-Glycidyl Nosylate is a compound useful in organic synthesis. (S)-(+)-Glycidyl Nosylate (cas# 115314-14-2) is a compound useful in organic synthesis.

Technology Process of (S)-Glycidyl 3-nitrobenzenesulfonate

There total 11 articles about (S)-Glycidyl 3-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: 100.0%

3-nitrobenzenesulphonyl chloride (121-51-7) + (R)-oxiranemethanol (57044-25-4) → (2s)-(+)-glycidyl 3-nitrobenzenesulfonate (115314-14-2)

Guidance literature:

With triethylamine; In dichloromethane; at 0 ℃; Inert atmosphere;

DOI:10.1002/anie.201302327

Reference yield: 93.0%

3-nitrobenzenesulphonyl chloride (121-51-7) + (S)-oxiranemethanol (60456-23-7) → (2s)-(+)-glycidyl 3-nitrobenzenesulfonate (115314-14-2)

Guidance literature:

With triethylamine; at -10 ℃; Inert atmosphere;

Reference yield: 92.0%

3-nitrobenzenesulphonyl chloride (121-51-7) + (S)-oxiranemethanol (60456-23-7) → (R)-glycidyl nosylate (115314-14-2,115314-17-5)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 1h;

upstream raw materials:

3-nitrobenzenesulphonyl chloride

(S)-oxiranemethanol

(R)-oxiranemethanol

glycidyl nosylate

Downstream raw materials:

3-O-oleyl-sn-glycerol 1-O-m-nitrobenzenesulfonate

1-O-oleyl-sn-glycerol 3-O-m-nitrobenzenesulfonate

3-O-petroselinyl-sn-glycerol 1-O-m-nitrobenzenesulfonate

1-O-Hexadecyl-sn-glycerol 3-(3'-nitrobenzenesulfonate)