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Pindone

Base Information Edit
  • Chemical Name:Pindone
  • CAS No.:83-26-1
  • Molecular Formula:C14H14 O3
  • Molecular Weight:230.263
  • Hs Code.:29143990
  • European Community (EC) Number:201-462-8
  • ICSC Number:1515
  • NSC Number:31211,6281
  • UN Number:2810,2588
  • UNII:2KFI1XBH7G
  • DSSTox Substance ID:DTXSID1025930
  • Nikkaji Number:J4.628K
  • Wikipedia:Pindone
  • Wikidata:Q2276931
  • Metabolomics Workbench ID:143643
  • ChEMBL ID:CHEMBL1369243
  • Mol file:83-26-1.mol
Pindone

Synonyms:pindone;pindone, sodium salt;pivaloylindan-1,3-dione

Suppliers and Price of Pindone
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
  • Packaging
  • price
  • TRC
  • 2-Pivaloyl-1,3-indandione
  • 250mg
  • $ 45.00
  • TRC
  • 2-Pivaloyl-1,3-indandione
  • 500mg
  • $ 70.00
  • Sigma-Aldrich
  • Pindone PESTANAL
  • 250mg
  • $ 54.00
  • Matrix Scientific
  • 2-Pivaloylindane-1,3-dione 98%
  • 1g
  • $ 230.00
  • Matrix Scientific
  • 2-Pivaloylindane-1,3-dione 98%
  • 10g
  • $ 1786.00
  • American Custom Chemicals Corporation
  • PINDONE 98.00%
  • 1G
  • $ 726.00
  • AK Scientific
  • Pindone
  • 1g
  • $ 360.00
Total 20 raw suppliers
Chemical Property of Pindone Edit
Chemical Property:
  • Appearance/Colour:solid 
  • Vapor Pressure:76.833mmHg at 25°C 
  • Melting Point:155 - 156 C 
  • Refractive Index:1.5557 (estimate) 
  • Boiling Point:82.987°C at 760 mmHg 
  • PKA:3.47±0.10(Predicted) 
  • Flash Point:-13.169°C 
  • PSA:51.21000 
  • Density:1.1914 (rough estimate) 
  • LogP:2.29700 
  • Storage Temp.:APPROX 20°C 
  • Solubility.:Soluble in most organic solvents (Worthing and Hance, 1991) 
  • Water Solubility.:18 ppm at 25 °C (Gunther et al., 1968) 
  • XLogP3:2.7
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:2
  • Exact Mass:230.094294304
  • Heavy Atom Count:17
  • Complexity:351
  • Transport DOT Label:Poison
Purity/Quality:

98%min *data from raw suppliers

2-Pivaloyl-1,3-indandione *data from reagent suppliers

Safty Information:
  • Pictogram(s): Toxic by inhalation and ingestion; inhibits blood clotting. TLV: 0.1 mg/m3
  • Hazard Codes:T,N 
  • Statements: 25-48/25-50/53 
  • Safety Statements: 37-45-60-61 
MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:
  • Chemical Classes:Pesticides -> Rodenticides, Anticoagulant
  • Canonical SMILES:CC(C)(C)C(=O)C1C(=O)C2=CC=CC=C2C1=O
  • Inhalation Risk:Evaporation at 20 °C is negligible; a harmful concentration of airborne particles can, however, be reached quickly , especially if powdered.
  • Effects of Short Term Exposure:The substance may cause effects on the blood. This may result in haemorrhage. The effects may be delayed. Medical observation is indicated.
  • Uses Insecticide; rodenticide Pindone may be used as an analytical reference standard for the quantification of the analyte in biological samples using different chromatography techniques.
Technology Process of Pindone

There total 6 articles about Pindone 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:
With dichloro bis(acetonitrile) palladium(II); potassium phosphate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In dimethyl sulfoxide; at 95 ℃; for 24h; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.joc.5b01758
Guidance literature:
Multi-step reaction with 3 steps
1.1: thionyl chloride / 4 h / 80 °C
2.1: lithium hexamethyldisilazane / toluene / 3 h / 0 °C / Inert atmosphere
2.2: 5 h / Inert atmosphere
3.1: dichloro bis(acetonitrile) palladium(II); 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; potassium phosphate / dimethyl sulfoxide / 24 h / 95 °C / Sealed tube; Inert atmosphere
With dichloro bis(acetonitrile) palladium(II); potassium phosphate; thionyl chloride; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; lithium hexamethyldisilazane; In dimethyl sulfoxide; toluene;
DOI:10.1021/acs.joc.5b01758
Guidance literature:
Multi-step reaction with 2 steps
1.1: lithium hexamethyldisilazane / toluene / 3 h / 0 °C / Inert atmosphere
1.2: 5 h / Inert atmosphere
2.1: dichloro bis(acetonitrile) palladium(II); 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; potassium phosphate / dimethyl sulfoxide / 24 h / 95 °C / Sealed tube; Inert atmosphere
With dichloro bis(acetonitrile) palladium(II); potassium phosphate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; lithium hexamethyldisilazane; In dimethyl sulfoxide; toluene;
DOI:10.1021/acs.joc.5b01758
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