D-chiro-inositol
- Product NameD-chiro-inositol
- CAS643-12-9
- CBNumberCB0718693
- MFC6H12O6
- MW180.16
- EINECS211-394-0
- MDL NumberMFCD00272608
- MOL File643-12-9.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 230 °C |
| Boiling point | 232.96°C (rough estimate) |
| Density | 1.2805 (rough estimate) |
| refractive index | 1.5730 (estimate) |
| storage temp. | 2-8°C |
| solubility | Water |
| form | Solid |
| pka | 12.63±0.70(Predicted) |
| color | White to Off-White |
| optical activity | [α]23/D +60°, c = 1.2 in H2O |
| Water Solubility | 403.4g/L(11 ºC) |
| InChI | InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4-,5+,6+/m0/s1 |
| InChIKey | CDAISMWEOUEBRE-LKPKBOIGSA-N |
| SMILES | O[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O |
| CAS DataBase Reference | 643-12-9(CAS DataBase Reference) |
| FDA UNII | 6R79WV4R10 |
Safety
| Hazard Codes | Xn |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 24/25-36-26 |
| WGK Germany | 3 |
| HS Code | 29061390 |
