4-Acetamido-2-acetyloxybenzenesulfonic acid;pyridine

Base Information

• Chemical Name: 4-Acetamido-2-acetyloxybenzenesulfonic acid;pyridine
• CAS No.: 5394-96-7
• Molecular Formula: C₅H₅N*C₁₀H₁₁NO₆S
• Molecular Weight: 352.368
• NSC Number: 1043
• DSSTox Substance ID: DTXSID10277180
• ChEMBL ID: CHEMBL1893764
• Mol file: 5394-96-7.mol

Synonyms:5394-96-7;MLS002637547;2-ACETOXY-4-(ACETYLAMINO)BENZENESULFONIC ACID COMPOUND WITH PYRIDINE (1:1);NSC1043;CHEMBL1893764;DTXSID10277180;HMS3078E05;NSC 1043;NSC-1043;SMR001547081

Chemical Property of 4-Acetamido-2-acetyloxybenzenesulfonic acid;pyridine

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 352.07290741
• Heavy Atom Count: 24
• Complexity: 457

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC(=C(C=C1)S(=O)(=O)O)OC(=O)C.C1=CC=NC=C1

Technology Process of 4-Acetamido-2-acetyloxybenzenesulfonic acid;pyridine

There total 2 articles about 4-Acetamido-2-acetyloxybenzenesulfonic acid;pyridine 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:

2-amino-4-acetylaminobenzene sulfonic acid (88-64-2) → 2-acetoxy-4-acetylamino-benzenesulfonic acid ; compound with pyridine (5394-96-7)

Guidance literature:

With copper(II) sulfate; Diazotization_.Behandeln des Reaktionsprodukts mit Acetanhydrid und Pyridin;

DOI:10.1021/ja01178a524

Reference yield:

pyridine (110-86-1) + acetic anhydride (108-24-7) → 2-acetoxy-4-acetylamino-benzenesulfonic acid ; compound with pyridine (5394-96-7)

Guidance literature:

upstream raw materials:

2-amino-4-acetylaminobenzene sulfonic acid

pyridine

acetic anhydride