Sorbitan, tri-(9Z)-9-octadecenoate (CAS 26266-58-0) — Citrus None Note Fragrance Ingredient
Sorbitan, tri-(9Z)-9-octadecenoate
CAS 26266-58-0
What Is Sorbitan, tri-(9Z)-9-octadecenoate?
Sorbitan trioleate is a synthetic compound used primarily as an emulsifier in cosmetics and personal care products. It helps blend oil and water components in creams, lotions, and fragrances. Consumers encounter it in moisturizers, makeup, and some perfumes as a stabilizing agent. While odorless itself, it plays a crucial role in maintaining the integrity of scented products by preventing separation of ingredients.
Safety Profile
GENERALLY SAFEWhat Does Sorbitan, tri-(9Z)-9-octadecenoate Smell Like?
Sorbitan trioleate is essentially odorless, functioning as a neutral carrier rather than a fragrant material. Its chemical structure lacks volatile groups that would contribute to aroma. In formulations, it serves as an invisible backbone – like the canvas for a painter – allowing other fragrant compounds to shine without interference.
2D Molecular Structure
SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(C1C(C(CO1)O)OC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC
Chemistry, Properties & Perfumer Guide
The Chemistry
Sorbitan trioleate is a synthetic ester formed from sorbitan and oleic acid. It belongs to the class of nonionic surfactants, specifically polyoxyethylene derivatives. The molecule features three oleate chains attached to a sorbitan core, creating an amphiphilic structure that can interact with both polar and nonpolar substances. Industrially, it’s produced through esterification reactions under controlled conditions.
Physical & Chemical Properties
| Appearance | Pale yellow viscous liquid |
|---|---|
| Solubility | Soluble in oils, insoluble in water |
Perfumer Guide
| Application | Typical % | Range | Notes |
|---|---|---|---|
| Emulsions | 1-5% | Up to 10% | Primary emulsifier |
| Fragrance Fixative | 0.5-2% | Up to 5% | Stabilizes volatile compounds |
Classic Accords
Tip: Use as a base for oil-soluble fragrance compounds to improve longevity.
Alternatives & Comparisons
Water-soluble alternative with similar emulsifying properties but different HLB value.
Safety, Regulatory & Sustainability
⚠ Regulatory Disclaimer
General reference only. Consult current IFRA Standards Library before formulating.
IFRA Status
No IFRA restrictions apply to this material.
RIFM Assessment
RIFM has evaluated similar sorbitan esters as safe for current cosmetic uses.
Sustainability
As a synthetic material, sorbitan trioleate production relies on petrochemical feedstocks. However, its high efficiency at low concentrations and biodegradability make it relatively environmentally favorable compared to some alternatives. Future green chemistry approaches may enable bio-based production routes.
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References
- PubChem Compound Summary for Sorbitan trioleate PubChem
Data: PubChem (NIH), PubMed, RIFM, IFRA. Last reviewed: Apr 2026.
Report a data errorIngredient Data Sheet
CAS 26266-58-0Physical Properties
| Molecular Weight | 957.5 g/mol🔬 PubChem |
| LogP (Octanol-Water) | 21.5🔬 PubChem |
| log Kp (skin permeability) | 6.724💻 Calculated |
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC(C1C(C(CO1)O)OC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC🔬 PubChem |
Odor & Flavor
| Functional Groups | esteralcoholetheralkene💻 RDKit |
Physical data: PubChem (NIH/NLM), U.S. EPA CompTox Dashboard, EPA OPERA models, RDKit. Odor & flavor: Arctander (Perfume & Flavor Chemicals), Fenaroli's Handbook of Flavor Ingredients, Leffingwell. Thresholds: van Gemert (Compilations of Odour Threshold Values). Regulatory: IFRA Standards 51st, FEMA GRAS. Trade names: Surburg (Common Fragrance & Flavor Materials). All data compiled and cross-referenced for perfumertools.com.
Physicochemical Properties
DTXSID: DTXSID6027892
Physical Properties
| Molecular Weight | 957.5 g/mol🔬 PubChem |
Partition & Solubility
| LogP (Octanol-Water) | 21.5 Log10 unitless🔬 PubChem |
Molecular Descriptors
| Topological Polar Surface Area | 108.36 Ų💻 Computed |
| H-Bond Donors | 1 count💻 Computed |
| H-Bond Acceptors | 8 count💻 Computed |
| Rotatable Bonds | 50 count💻 Computed |
| Molar Refractivity | 284.82 cm^3/mol💻 Computed |
Data Sources:
🔬 EPA Experimental data from U.S. EPA CompTox Chemicals Dashboard & CTX APIs. 📊 OPERA Predicted using EPA's OPERA QSAR models. 💻 Computed Calculated from SMILES using RDKit.
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