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Nothoapiole

Base Information Edit
  • Chemical Name:Nothoapiole
  • CAS No.:22934-74-3
  • Molecular Formula:C13H16O5
  • Molecular Weight:252.267
  • Hs Code.:
  • UNII:U5MRY34GEB
  • DSSTox Substance ID:DTXSID30945617
  • Nikkaji Number:J1.139.218K
  • Wikipedia:Nothoapiole
  • Wikidata:Q21099684
  • Mol file:22934-74-3.mol
Nothoapiole

Synonyms:nothoapiole

Suppliers and Price of Nothoapiole
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
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Total 0 raw suppliers
Chemical Property of Nothoapiole Edit
Chemical Property:
  • Vapor Pressure:0.000736mmHg at 25°C 
  • Boiling Point:317°C at 760 mmHg 
  • Flash Point:125.1°C 
  • Density:1.162g/cm3 
  • XLogP3:2.7
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:5
  • Exact Mass:252.09977361
  • Heavy Atom Count:18
  • Complexity:283
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:COC1=C(C(=C(C2=C1OCO2)OC)OC)CC=C
Technology Process of Nothoapiole

There total 4 articles about Nothoapiole 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:
Guidance literature:
6-allyl-4,7-dimethoxy-1,3-benzodioxol-5-ol; With sodium hydroxide; In N,N-dimethyl-formamide; at 20 ℃; for 0.333333h;
dimethyl sulfate; In N,N-dimethyl-formamide; for 2h;
DOI:10.1021/acs.jnatprod.8b00878
Guidance literature:
Multi-step reaction with 4 steps
1.1: formic acid; dihydrogen peroxide / 20 °C
2.1: sodium hydroxide / N,N-dimethyl-formamide / 0.33 h / 20 °C
2.2: 1 h
3.1: N,N-dimethyl-aniline / 2.5 h / Reflux
4.1: sodium hydroxide / N,N-dimethyl-formamide / 0.33 h / 20 °C
4.2: 2 h
With formic acid; dihydrogen peroxide; N,N-dimethyl-aniline; sodium hydroxide; In N,N-dimethyl-formamide; 3.1: |Claisen Rearrangement;
DOI:10.1021/acs.jnatprod.8b00878
Guidance literature:
Multi-step reaction with 3 steps
1.1: sodium hydroxide / N,N-dimethyl-formamide / 0.33 h / 20 °C
1.2: 1 h
2.1: N,N-dimethyl-aniline / 2.5 h / Reflux
3.1: sodium hydroxide / N,N-dimethyl-formamide / 0.33 h / 20 °C
3.2: 2 h
With N,N-dimethyl-aniline; sodium hydroxide; In N,N-dimethyl-formamide; 2.1: |Claisen Rearrangement;
DOI:10.1021/acs.jnatprod.8b00878
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