HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 454542Generated: October 23, 2026
Triton X-100.11
OCTOXYNOL-11 · 3,6,9,12,15,18,21,24,27,30-Decaoxadotriacontan-1-ol, 32-[4-(1,1,3,3-tetramethylbutyl)phenoxy]- · 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
https://huagongshe.com/en/chemical/454542
Identifiers & Physical Properties
| CAS No. | 108437-62-3 |
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| Molecular formula | C36H66O12 |
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| Average molar mass | 690.9 g/mol |
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| Monoisotopic mass | 690.45542755 g/mol |
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| SMILES | CC(C)(C)CC(C)(C)c1ccc(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)cc1 |
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| InChIKey | AIOCLJDAYKBSTO-UHFFFAOYSA-N |
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| PubChem CID | 454542 |
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| DTXSID | DTXSID101018300 |
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Chemical & Physical Properties
| XLogP | 3.1 |
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| Topological polar surface area | 122 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 12 |
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| Rotatable bonds | 36 |
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| Heavy atoms | 48 |
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| Formal charge | 0 |
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| Complexity | 668 |
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| Cosmetics | Cosmetic ingredients (Octoxynol-11) -> CIR (Cosmetic Ingredient Review)EmulsifyingSurfactant |
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| Boiling point | 694.2±55.0 °C(Predicted) |
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| Density | 1.056±0.06 g/cm3(Predicted) |
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| pKa (acidity coefficient) | 14.36±0.10(Predicted) |
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| Cosmetic Ingredient Review (CIR) | OCTOXYNOL-11 (108437-62-3) |
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| EWG's Food Scores | 4-8 |
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| FDA UNII | SQL994V0M6 |
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Safety & Regulations
| Toxicity summary | Safe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org |
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