1,2-Dioctanoylglycerol

Base Information

• Chemical Name: 1,2-Dioctanoylglycerol
• CAS No.: 36354-80-0
• Molecular Formula: C19H36O5
• Molecular Weight: 344.49
• European Community (EC) Number: 252-992-1
• UNII: SA9937IP23
• DSSTox Substance ID: DTXSID00910175
• Nikkaji Number: J118.318D
• Wikidata: Q27289107
• NCI Thesaurus Code: C66186
• ChEMBL ID: CHEMBL24609
• Mol file: 36354-80-0.mol

Synonyms:1,2-dicapryloylglycerol;1,2-dioctanoyl-rac-glycerol;1,2-dioctanoyl-sn-glycerol;1,2-dioctanoylglycerol;1,2-dioctanoylglycerol, (S)-isomer;diC8;dicaprylglyceride;sn-1,2-dioctanoylglycerol

Chemical Property of 1,2-Dioctanoylglycerol

Chemical Property:

• Vapor Pressure: 1.38E-09mmHg at 25°C
• Boiling Point: 439.9°Cat760mmHg
• Flash Point: 141.5°C
• PSA: 72.83000
• Density: 0.992g/cm³
• LogP: 4.15470
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 18
• Exact Mass: 344.25627424
• Heavy Atom Count: 24
• Complexity: 317

Purity/Quality:

98%Min ^*data from raw suppliers

Dioctanoin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC
• Description: Dioctanoin is a diacylglycerol that contains the saturated short-chain fatty acid octanoic acid at two positions.