4-Pentylphenyl 4-propylbenzoate
- Product Name4-Pentylphenyl 4-propylbenzoate
- CAS50649-60-0
- MFC21H26O2
- MW310.43
- EINECS256-684-8
- MOL File50649-60-0.mol
Chemical Properties
| Melting point | 15-18℃ |
| Boiling point | 433.9±34.0 °C(Predicted) |
| Density | 0.989 g/mL at 25 °C |
| refractive index | n |
| Flash point | >230 °F |
| storage temp. | 2-8°C |
| form | liquid crystal |
| InChI | 1S/C21H26O2/c1-3-5-6-8-18-11-15-20(16-12-18)23-21(22)19-13-9-17(7-4-2)10-14-19/h9-16H,3-8H2,1-2H3 |
| InChIKey | WNBFPAKRCJNBBS-UHFFFAOYSA-N |
| SMILES | CCCCCc1ccc(OC(=O)c2ccc(CCC)cc2)cc1 |
| CAS DataBase Reference | 50649-60-0(CAS DataBase Reference) |
| EPA Substance Registry System | Benzoic acid, 4-propyl-, 4-pentylphenyl ester (50649-60-0) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 41 |
| Safety Statements | 26-36/37/39 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Chronic 4 |
