| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 26942-95-0 |
| ECHA EC Number: | 248-122-5 |
| FDA UNII: | 71503RH8KG |
| Category: | emollients, viscosity controlling |
| IUPAC Name: | triisostearin |
| InChI : | InChI=1/C57H110O6/c1-51(2)43-37-31-25-19-13-7-10-16-22-28-34-40-46-55(58)61-49-54(63-57(60)48-42-36-30-24-18-12-9-15-21-27-33-39-45-53(5)6)50-62-56(59)47-41-35-29-23-17-11-8-14-20-26-32-38-44-52(3)4/h51-54H,7-50H2,1-6H3 |
| Std.InChI: | InChI=1S/C57H110O6/c1-51(2)43-37-31-25-19-13-7-10-16-22-28-34-40-46-55(58)61-49-54(63-57(60)48-42-36-30-24-18-12-9-15-21-27-33-39-45-53(5)6)50-62-56(59)47-41-35-29-23-17-11-8-14-20-26-32-38-44-52(3)4/h51-54H,7-50H2,1-6H3 |
| InChIKey : | JNAYPSWVMNJOPQ-UHFFFAOYAG |
| Std.InChIKey: | JNAYPSWVMNJOPQ-UHFFFAOYSA-N |
| SMILES : | CC(C)CCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCC(C)C |
| Molar Refractivity : | 271.28 ± 0.3 cm3 (est) |
| Parachor : | 2363.6 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.464 ± 0.02 (est) |
| Surface Tension : | 33.6 ± 3.0 dyne/cm (est) |
| Density : | 0.908 ± 0.06 g/cm3 (est) |
| Polarizability : | 107.54 ± 0.5 10-24cm3 (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 806.00 to 807.00 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 566.00 °F. TCC ( 296.70 °C. ) (est) |
| logP (o/w): | 24.204 (est) |
| Soluble in: | |
| water, 1.007e-020 mg/L @ 25 °C (est) | |
| Croda |
| Crodamol™ GTIS Odor: bland Use: Soft spreading, occlusive emollient that is non-migrating once on skin. Ideal for eye-contour products, treatment cosmetics and emulsions for dry skin and night care. |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| emollients, viscosity controlling | |||
| Recommendation for triisostearin usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for triisostearin flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):26942-95-0 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :168634 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:1 |
| 2,3-bis(16-methylheptadecanoyloxy)propyl 16-methylheptadecanoate |
| Chemidplus:0026942950 |
| 2,3-bis(16-methylheptadecanoyloxy)propyl 16-methylheptadecanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 168634 |
| Pubchem (sid): | 135123037 |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
| None Found |
| emollients | |
| solvents | |
| viscosity controlling agents |
| not found in nature |
| glycerin triisostearate | |
| glycerol triisostearate | |
| 2,3-bis(16- | methylheptadecanoyloxy)propyl 16-methylheptadecanoate |
| 1,2,3- | propane triyl triisooctadecanoate |
| iso | stearic acid triglyceride |
