20736-11-2
| Name | C-6-G HYDRATE-TRIFLUOROACETATE |
| CAS | 20736-11-2 |
| Molecular Formula | C24H29NO9 |
| MDL Number | MFCD00214264 |
| Molecular Weight | 475.49 |
| MOL File | 20736-11-2.mol |
Chemical Properties
| Appearance | White Fluffy Solid |
| Melting point | 248-250°C (dec.) |
| Boiling point | 713.4±60.0 °C(Predicted) |
| density | 1.56±0.1 g/cm3(Predicted) |
| Fp | 43℃ |
| storage temp. | −20°C |
| solubility | DMSO (Slightly), Methanol (Slightly), Water (Slightly) |
| form | Solid |
| pka | 2.79±0.70(Predicted) |
| color | White to Off-White |
| Major Application | forensics and toxicology |
| InChIKey | CRWVOYRJXPDBPM-HSCJLHHPSA-N |
| SMILES | [H][C@]1([C@H](N(C)CC2)C3)[C@@]42C5=C3C=CC(OC)=C5O[C@H]4[C@@H](O[C@@H]6O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]6O)C=C1 |
Safety Data
| Hazard Codes | T |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 1993C 3 / PGIII |
| WGK Germany | 3 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Flam. Liq. 3 STOT SE 1 |