3-Dehydroquinic acid potassium salt, (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid potassium salt
- Product Name3-Dehydroquinic acid potassium salt, (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid potassium salt
- CAS494211-79-9
- CBNumberCB82100207
- MFC7H9O6.K
- MW228.24
- MDL NumberMFCD11045271
- MOL File494211-79-9.mol
- MSDS FileSDS
Chemical Properties
| storage temp. | 2-8°C |
| form | powder |
| optical activity | [α]/D -48.0±4.0°, c = 1.5 in H2O |
| InChI | 1S/C7H10O6.K/c8-3-1-7(13,6(11)12)2-4(9)5(3)10;/h3,5,8,10,13H,1-2H2,(H,11,12);/q;+1/p-1/t3-,5+,7-;/m1./s1 |
| InChIKey | XOXNBNMEMILWBJ-HOMRGJANSA-M |
| SMILES | [K+].O[C@@H]1C[C@@](O)(CC(=O)[C@H]1O)C([O-])=O |
| UNSPSC Code | 12352204 |
| NACRES | NA.32 |
Safety
| Symbol(GHS) |
|
| Signal word | Danger |
| Hazard statements | H301 |
| Precautionary statements | P301+P310+P330 |
| Hazard Codes | T |
| Risk Statements | 25 |
| Safety Statements | 45 |
| RIDADR | UN 2811 6.1 / PGIII |
| WGK Germany | 3 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral |