(14R)-2β,3β-Epoxygrayanotoxane-5,6β,10,14,16-pentol 6-acetate
- Product Name(14R)-2β,3β-Epoxygrayanotoxane-5,6β,10,14,16-pentol 6-acetate
- CAS26116-89-2
- CBNumberCB92241585
- MFC22H34O7
- MW410.5
- EINECS300-009-1
- MDL NumberMFCD01714941
- MOL File26116-89-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 294.5-296℃ |
| Boiling point | 569.4±50.0 °C(Predicted) |
| Density | 1.36±0.1 g/cm3 (20 ºC 760 Torr) |
| storage temp. | -20°C |
| form | Solid |
| pka | 13.27±0.70(Predicted) |
| color | White to off-white |
| InChI | 1S/C22H34O7/c1-10(23)28-13-8-21-9-19(4,25)11(16(21)24)6-7-12(21)20(5,26)15-14-17(29-14)18(2,3)22(13,15)27/h11-17,24-27H,6-9H2,1-5H3 |
| InChIKey | FJISLLRXVSQIES-UHFFFAOYSA-N |
| SMILES | O=C(C)O[C@H](C[C@]1(C[C@@](C)(O)[C@@H]([C@@H]1O)CC2)[C@]2([H])[C@@]3(C)O)[C@@]4(O)[C@@]3([H])[C@H]5[C@H](O5)C4(C)C |
| FDA UNII | X2F6R0716P |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
Safety
| Symbol(GHS) |
|
| Signal word | Danger |
| Hazard statements | H300+H310 |
| Precautionary statements | P262-P264-P270-P280-P301+P310-P302+P352+P310 |
| WGK Germany | WGK 3 |
| Storage Class | 6.1A - Combustible acute toxic Cat. 1 and 2 very toxic hazardous materials |
| Hazard Classifications | Acute Tox. 2 Dermal Acute Tox. 2 Oral |
