1,3-Benzodioxole-5-glycolic acid
- Product Name1,3-Benzodioxole-5-glycolic acid
- CAS27738-46-1
- CBNumberCB7394359
- MFC9H8O5
- MW196.16
- EINECS248-628-6
- MDL NumberMFCD00043585
- MOL File27738-46-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 158-162 °C |
| Boiling point | 403.5±45.0 °C(Predicted) |
| Density | 1.553±0.06 g/cm3(Predicted) |
| storage temp. | Hygroscopic, Refrigerator, Under inert atmosphere |
| solubility | Aqueous Base (Slightly), DMSO (Slightly), Methanol (Slightly, Sonicated) |
| form | Solid |
| pka | 3.39±0.11(Predicted) |
| color | White to Light Brown |
| BRN | 209546 |
| Stability | Hygroscopic |
| InChI | 1S/C9H8O5/c10-8(9(11)12)5-1-2-6-7(3-5)14-4-13-6/h1-3,8,10H,4H2,(H,11,12) |
| InChIKey | CLUJFRCEPFNVHW-UHFFFAOYSA-N |
| SMILES | OC(C(O)=O)c1ccc2OCOc2c1 |
| CAS DataBase Reference | 27738-46-1(CAS DataBase Reference) |
| FDA UNII | 4ZYA58BQJ8 |
| UNSPSC Code | 12352100 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
