Eugenol sulfate

Base Information

• Chemical Name: Eugenol sulfate
• CAS No.: 95480-60-7
• Molecular Formula: C10H12 O5 S
• Molecular Weight: 244.268
• DSSTox Substance ID: DTXSID20241857
• Wikidata: Q83125422
• Metabolomics Workbench ID: 78541
• Mol file: 95480-60-7.mol

Synonyms:eugenol sulfate;95480-60-7;(2-methoxy-4-prop-2-enylphenyl) hydrogen sulfate;Phenol, 2-methoxy-4-(2-propen-1-yl)-, 1-(hydrogen sulfate);Schwefelsaure Eugenol;SCHEMBL18729782;DTXSID20241857;CHEBI:133570;4-allyl-2-methoxyphenyl hydrogen sulfate;(4-allyl-2-methoxy-phenyl) hydrogen sulfate;2-methoxy-4-(prop-2-en-1-yl)phenyl hydrogen sulfate;sulfuric acid mono-(4-allyl-2-methoxy-phenyl ester)

Chemical Property of Eugenol sulfate

Chemical Property:

• Density: 1.328g/cm³
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 244.04054465
• Heavy Atom Count: 16
• Complexity: 319

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)CC=C)OS(=O)(=O)O

Technology Process of Eugenol sulfate

There total 1 articles about Eugenol sulfate 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: 25.1%

4-allylguaiacol (97-53-0) → [2-methoxy-4-(prop-2-en-1-yl)phenyl]oxidanesulfonic acid (95480-60-7)

Guidance literature:

With pyridine; chlorosulfonic acid; at 20 ℃; for 72h; Time;

upstream raw materials:

4-allylguaiacol