CRL-40,940 C15H13F2NO2S structure – Flashcards
Flashcard maker : Blake Terry
| Molecular Formula | C15H13F2NO2S |
| Average mass | 309.331 Da |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 558.7±50.0 °C at 760 mmHg |
| Flash Point | 291.7±30.1 °C |
| Molar Refractivity | 77.3±0.3 cm3 |
| Polarizability | 30.6±0.5 10-24cm3 |
| Surface Tension | 60.0±3.0 dyne/cm |
| Molar Volume | 221.3±3.0 cm3 |
- Predicted – ACD/Labs
- Predicted – ChemAxon
Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module
| Density: | 1.4±0.1 g/cm3 |
| Boiling Point: | 558.7±50.0 °C at 760 mmHg |
| Vapour Pressure: | 0.0±1.5 mmHg at 25°C |
| Enthalpy of Vaporization: | 84.1±3.0 kJ/mol |
| Flash Point: | 291.7±30.1 °C |
| Index of Refraction: | 1.615 |
| Molar Refractivity: | 77.3±0.3 cm3 |
| #H bond acceptors: | 3 |
| #H bond donors: | 2 |
| #Freely Rotating Bonds: | 5 |
| #Rule of 5 Violations: | 0 |
| ACD/LogP: | 1.27 |
| ACD/LogD (pH 5.5): | 1.46 |
| ACD/BCF (pH 5.5): | 7.63 |
| ACD/KOC (pH 5.5): | 149.02 |
| ACD/LogD (pH 7.4): | 1.46 |
| ACD/BCF (pH 7.4): | 7.63 |
| ACD/KOC (pH 7.4): | 149.02 |
| Polar Surface Area: | 79 Å2 |
| Polarizability: | 30.6±0.5 10-24cm3 |
| Surface Tension: | 60.0±3.0 dyne/cm |
| Molar Volume: | 221.3±3.0 cm3 |
Click to predict properties on the Chemicalize site
