Basic Information
| Drug ID | DDPD04827 |
|
| Drug Name | Urethane | |
| Molecular Weight | 89.0932 | |
| Molecular Formula | C3H7NO2 | |
| CAS Number | 51-79-6 | |
| SMILES | CCOC(N)=O | |
| External Links | ||
| DRUGBANK | DB04827 | |
| T3DB | T3D4583 | |
| ATSDR | ATSDR Page | |
| PubChem Compound | 5641 | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | -0.15 | - | -0.15 | - | HANSCH,C ET AL. (1995) |
| Boiling Point | 185.0 | ℃ | 185 | ℃ | PhysProp |
| Melting Point | 49.0 | ℃ | 49 | ℃ | PhysProp |
| Water Solubility | 480000.0 | mg/L | 480000 | mg/L | SEIDELL,A 1941) |
| Log S | 0.85 | - | 0.85 | - | ADME Research, USCD |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Toxicity LD50 | 2000.0 | mg/kg | 2.0 | g/kg | rodents; | T3DB |
| Toxicity MRLs | 0.30 | mg/kg/day | >0.3 | mg/kg/day | depression; | T3DB |
Maximum Dosage
Not Available
Drug Property Radar Chart
Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1