Chemical Properties
| Melting point | 85-88° |
| alpha | D20 +9.2° (alc); D30 +42.5° (c = 2 in dioxane) |
| Boiling point | 434.13°C (rough estimate) |
| Density | 1.2086 (rough estimate) |
| refractive index | 1.5300 (estimate) |
| storage temp. | -20°C |
| form | solid |
| Major Application | metabolomics vitamins, nutraceuticals, and natural products |
| Cosmetics Ingredients Functions | SKIN CONDITIONING |
| InChI | 1S/C21H24O7/c1-6-11(2)20(24)27-19-18(25-12(3)22)16-14(28-21(19,4)5)9-7-13-8-10-15(23)26-17(13)16/h7-11,18-19H,6H2,1-5H3/t11-,18-,19-/m1/s1 |
| InChIKey | GVBNSPFBYXGREE-CXWAGAITSA-N |
| SMILES | CC[C@@H](C)C(=O)O[C@@H]1[C@H](OC(C)=O)c2c(OC1(C)C)ccc3C=CC(=O)Oc23 |
| CAS DataBase Reference | 477-32-7 |
Safety Information
| Hazard Codes | Xn,N |
| Risk Statements | 22-50 |
| Safety Statements | 61 |
| RIDADR | UN 3077 9 / PGIII |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Acute 1 Aquatic Chronic 1 |
| Toxicity | LD50 in mice (mg/kg): 2240 orally; >370 s.c. (Erbring) |
