Catalog | DGS1338438 |
CAS | 1338-43-8 |
Structure | ![]() |
Synonyms | Sorbitan monooleate |
IUPAC Name | [2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl] octadec-9-enoate |
Molecular Weight | 428.6 |
Molecular Formula | C24H44O6 |
InChI | InChI=1S/C24H44O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)29-19-21(26)24-23(28)20(25)18-30-24/h9-10,20-21,23-26,28H,2-8,11-19H2,1H3 |
InChI Key | NWGKJDSIEKMTRX-UHFFFAOYSA-N |
Boiling Point | >100 °C |
Melting Point | 0.986°C |
Flash Point | 148.9 °C |
Density | 0.986 g/mL at 25 °C (lit.) |
Appearance | Yellow viscous liquid |
Complexity | 453 |
EC Number | 215-665-4 |
Exact Mass | 428.31378912 |
Formal Charge | 0 |
Heavy Atom Count | 30 |
Hydrogen Bond Acceptor Count | 6 |
Hydrogen Bond Donor Count | 3 |
Isomeric SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC(C1C(C(CO1)O)O)O |
MDL Number | MFCD00080948 |
Monoisotopic Mass | 428.31378912 |
Rotatable Bond Count | 19 |
Stability | Stable. Combustible. Incompatible with strong oxidizing agents. |
Storage Conditions | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
Topological Polar Surface Area | 96.2 Ų |
XLogP3-AA | 6 |
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