1-Amino-4-oxocyclohexanecarboxylic acid ethylene ketal
- Product Name1-Amino-4-oxocyclohexanecarboxylic acid ethylene ketal
- CAS54621-18-0
- MFC9H15NO4
- MW201.22
- EINECS
- MOL File54621-18-0.mol
Chemical Properties
| Melting point | 301-304°C |
| Boiling point | 372.1±42.0 °C(Predicted) |
| Density | 1.32±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 2.36±0.20(Predicted) |
| form | solid |
| Appearance | White to off-white Solid |
| Water Solubility | Insoluble in water. |
| BRN | 1373325 |
| InChI | 1S/C9H15NO4/c10-8(7(11)12)1-3-9(4-2-8)13-5-6-14-9/h1-6,10H2,(H,11,12) |
| InChIKey | HIIFALCQUKTUHB-UHFFFAOYSA-N |
| SMILES | NC1(CCC2(CC1)OCCO2)C(O)=O |
| CAS DataBase Reference | 54621-18-0(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,Xn |
| Risk Statements | 22-41 |
| Safety Statements | 22-24/25-39-26 |
| WGK Germany | 1 |
| HazardClass | IRRITANT |
| HS Code | 2916399090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 |
