Chemical Property of 1,3-Diolein
Chemical Property:
- Vapor Pressure:2.58E-21mmHg at 25°C
- Melting Point:21.5°C
- Refractive Index:1.4800 (estimate)
- Boiling Point:678.3°Cat760mmHg
- PKA:12.63±0.20(Predicted)
- Flash Point:189.2°C
- PSA:72.83000
- Density:0.934g/cm3
- LogP:11.50870
- Storage Temp.:−20°C
- XLogP3:14.3
- Hydrogen Bond Donor Count:1
- Hydrogen Bond Acceptor Count:5
- Rotatable Bond Count:36
- Exact Mass:620.53797539
- Heavy Atom Count:44
- Complexity:615
- Purity/Quality:
-
≥99% (GC) *data from raw suppliers
1,3-Diolein *data from reagent suppliers
Safty Information:
- Pictogram(s):
Xi
- Hazard Codes:Xi
- Statements:
36/37/38
- Safety Statements:
26-36
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)O
- Isomeric SMILES:CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC/C=C\CCCCCCCC
-
Uses
1,3-Dioleoylglycerol is used in the synthesis of amphiphilic gadolinium complexes as MRI contrast agents.