92264-81-8
| Name | Hydroxybupropione |
| CAS | 92264-81-8 |
| EINECS(EC#) | 200-835-2 |
| Molecular Formula | C13H18ClNO2 |
| MDL Number | MFCD03701187 |
| Molecular Weight | 255.74 |
| MOL File | 92264-81-8.mol |
Chemical Properties
| Appearance | Off-White Solid |
| Melting point | 121-123°C |
| Boiling point | 393.9±32.0 °C(Predicted) |
| density | 1.150±0.06 g/cm3(Predicted) |
| Fp | 2℃ |
| storage temp. | ?20°C |
| solubility | Acetonitrile (Slightly), Chloroform (Slightly), DMSO (Slightly) |
| form | Solid |
| pka | 15.43±0.10(Predicted) |
| color | White to Pale Yellow |
| Major Application | clinical testing |
| InChI | 1S/C13H18ClNO2/c1-9-13(16,17-8-12(2,3)15-9)10-5-4-6-11(14)7-10/h4-7,9,15-16H,8H2,1-3H3 |
| InChIKey | RCOBKSKAZMVBHT-UHFFFAOYSA-N |
| SMILES | ClC1=CC(C2(O)C(C)NC(C)(C)CO2)=CC=C1 |
Safety Data
| Symbol(GHS) |   GHS02,GHS07 |
| Signal word | Danger |
| Hazard statements | H225-H302+H312+H332-H319 |
| Precautionary statements | P210-P261-P302+P352+P312-P304+P340+P312-P337+P313-P403+P235 |
| Hazard Codes | F,Xn |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 1648 3 / PGII |
| WGK Germany | 2 |
| HS Code | 3822900000 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Flam. Liq. 2 |