Triphasiol

Base Information

• Chemical Name: Triphasiol
• CAS No.: 81445-98-9
• Molecular Formula: C19H24O6
• Molecular Weight: 348.3903
• DSSTox Substance ID: DTXSID201001994
• Nikkaji Number: J668.270G
• Wikidata: Q82996025
• Metabolomics Workbench ID: 48418

Synonyms:Triphasiol;81445-98-9;2H-1-Benzopyran-2-one, 7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)-;CHEBI:175421;DTXSID201001994;7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)chromen-2-one;7-(2,3-Dihydroxy-3-methylbutoxy)-8-(2-oxo-3-methylbutyl)coumarin;7-(2,3-dihydroxy-3-methyl-butoxy)-8-(3-methyl-2-oxo-butyl)chromen-2-one;7-(2,3-Dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)-2H-1-benzopyran-2-one;7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)-2H-chromen-2-one

Chemical Property of Triphasiol

Chemical Property:

• Vapor Pressure: 1.63E-13mmHg at 25°C
• Boiling Point: 563°Cat760mmHg
• Flash Point: 200.1°C
• Density: 1.233g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 348.15728848
• Heavy Atom Count: 25
• Complexity: 524

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(=O)CC1=C(C=CC2=C1OC(=O)C=C2)OCC(C(C)(C)O)O

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