Basic Information
| Drug ID | DDPD00676 |
|
| Drug Name | Benzyl benzoate | |
| Molecular Weight | 212.2439 | |
| Molecular Formula | C14H12O2 | |
| CAS Number | 120-51-4 | |
| SMILES | O=C(OCC1=CC=CC=C1)C1=CC=CC=C1 | |
| External Links | ||
| DRUGBANK | DB00676 | |
| PubChem Compound | 2345 | |
| Drugs.com | Drugs.com Drug Page | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | 3.97 | - | 3.97 | - | HANSCH,C ET AL. (1995) |
| Boiling Point | 323.5 | ℃ | 323.5 | ℃ | PhysProp |
| Melting Point | 21.0 | ℃ | 21 | ℃ | PhysProp |
| Water Solubility | 15.4 | mg/L | 15.4 | mg/L | DRUGBANK |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Toxicity LD50 | 1680.0 | mg/kg | 1680.0 | mg/kg | PO, oral; rabbit; | DRUGBANK | Toxicity LD50 | 4000.0 | mg/kg | 4000.0 | mg/kg | skin/dermal; rabbit; | DRUGBANK |
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