3-Bromo-1-adamantaneacetic acid
- Product Name3-Bromo-1-adamantaneacetic acid
- CAS17768-34-2
- CBNumberCB4947792
- MFC12H17BrO2
- MW273.17
- MDL NumberMFCD00154387
- MOL File17768-34-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 194-200 °C |
| Boiling point | 373.3±15.0 °C(Predicted) |
| Density | 1.556±0.06 g/cm3(Predicted) |
| pka | 4.72±0.10(Predicted) |
| form | solid |
| InChI | 1S/C12H17BrO2/c13-12-4-8-1-9(5-12)3-11(2-8,7-12)6-10(14)15/h8-9H,1-7H2,(H,14,15)/t8-,9+,11-,12- |
| InChIKey | HFGLWCBEPPFDDJ-VSKBNFNDSA-N |
| SMILES | OC(=O)C[C@]12C[C@H]3C[C@H](C[C@](Br)(C3)C1)C2 |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H319 |
| Precautionary statements | P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36 |
| Safety Statements | 26 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 |