| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 101-34-8 |
| ECHA EC Number: | 202-935-1 |
| FDA UNII: | 6TX6N2LEXN |
| Category: | emollients, skin conditioning, solvents |
| IUPAC Name: | glyceryl triacetyl ricinoleate |
| InChI : | InChI=1/C63H110O12/c1-7-10-13-34-43-57(72-54(4)64)46-37-28-22-16-19-25-31-40-49-61(67)70-52-60(75-63(69)51-42-33-27-21-18-24-30-39-48-59(74-56(6)66)45-36-15-12-9-3)53-71-62(68)50-41-32-26-20-17-23-29-38-47-58(73-55(5)65)44-35-14-11-8-2/h28-30,37-39,57-60H,7-27,31-36,40-53H2,1-6H3/b37-28+,38-29+,39-30+ |
| Std.InChI: | InChI=1S/C63H110O12/c1-7-10-13-34-43-57(72-54(4)64)46-37-28-22-16-19-25-31-40-49-61(67)70-52-60(75-63(69)51-42-33-27-21-18-24-30-39-48-59(74-56(6)66)45-36-15-12-9-3)53-71-62(68)50-41-32-26-20-17-23-29-38-47-58(73-55(5)65)44-35-14-11-8-2/h28-30,37-39,57-60H,7-27,31-36,40-53H2,1-6H3/b37-28+,38-29+,39-30+ |
| InChIKey : | RIXCYAQOGLLEIU-OTDRRXFEBW |
| Std.InChIKey: | RIXCYAQOGLLEIU-OTDRRXFESA-N |
| SMILES : | CCCCCC)COC(=O)CCCCCCC/C=C/CC(OC(=O)C)CCCCCCCCCCCCC(OC(=O)C)C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(OC(=O)C) |
| Molar Refractivity : | 304.57 ± 0.3 cm3 (est) |
| Parachor : | 2638.1 ± 4.0 cm3 (est) |
| Index of Refraction : | 1.480 ± 0.02 (est) |
| Surface Tension : | 36.7 ± 3.0 dyne/cm (est) |
| Density : | 0.988 ± 0.06 g/cm3 (est) |
| Polarizability : | 120.74 ± 0.5 10-24cm3 (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 904.00 to 905.00 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 618.00 °F. TCC ( 325.80 °C. ) (est) |
| logP (o/w): | 20.131 (est) |
| Soluble in: | |
| water, 3.823e-020 mg/L @ 25 °C (est) | |
| None found |
| 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, skin conditioning, solvents | |||
| Recommendation for glyceryl triacetyl ricinoleate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for glyceryl triacetyl ricinoleate 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):101-34-8 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :5462724 |
| National Institute of Allergy and Infectious Diseases:Data |
| 2,3-bis[[(E)-12-acetyloxyoctadec-9-enoyl]oxy]propyl (E)-12-acetyloxyoctadec-9-enoate |
| Chemidplus:0000101348 |
| 2,3-bis[[(E)-12-acetyloxyoctadec-9-enoyl]oxy]propyl (E)-12-acetyloxyoctadec-9-enoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 101-34-8 |
| Pubchem (cid): | 5462724 |
| Pubchem (sid): | 135059136 |
| (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 |
| 2,3-bis[[(E)-12- | acetyloxyoctadec-9-enoyl]oxy]propyl (E)-12-acetyloxyoctadec-9-enoate |
| glyceryl tri(acetylricinoleate) | |
| naturechem GTR | |
| 9- | octadecenoic acid, 12-(acetyloxy)-, 1,2,3-propanetriyl ester, (9Z,9'Z,9''Z,12R,12'R,12''R)- |
| plasticizer A-100D | |
| 1,2,3- | propane triyl tris((R)-12-(acetoxy)oleate) |
| 1,2,3- | propanetriyl 12-(acetyloxy)-9-octadecenoate |
| ricinolein, tri-, triacetate |
