3-[4-(2-Methyl-2-propanyl)phenyl]-2-propynal C13H14O structure – Flashcards
Flashcard maker : Ray Collins
| Molecular Formula | C13H14O |
| Average mass | 186.250 Da |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 289.2±19.0 °C at 760 mmHg |
| Flash Point | 107.7±18.5 °C |
| Molar Refractivity | 57.5±0.4 cm3 |
| Polarizability | 22.8±0.5 10-24cm3 |
| Surface Tension | 39.3±5.0 dyne/cm |
| Molar Volume | 185.6±5.0 cm3 |
- Predicted – ACD/Labs
- Predicted – ChemAxon
Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module
| Density: | 1.0±0.1 g/cm3 |
| Boiling Point: | 289.2±19.0 °C at 760 mmHg |
| Vapour Pressure: | 0.0±0.6 mmHg at 25°C |
| Enthalpy of Vaporization: | 50.7±3.0 kJ/mol |
| Flash Point: | 107.7±18.5 °C |
| Index of Refraction: | 1.532 |
| Molar Refractivity: | 57.5±0.4 cm3 |
| #H bond acceptors: | 1 |
| #H bond donors: | 0 |
| #Freely Rotating Bonds: | 3 |
| #Rule of 5 Violations: | 0 |
| ACD/LogP: | 4.56 |
| ACD/LogD (pH 5.5): | 4.02 |
| ACD/BCF (pH 5.5): | 669.35 |
| ACD/KOC (pH 5.5): | 3666.12 |
| ACD/LogD (pH 7.4): | 4.02 |
| ACD/BCF (pH 7.4): | 669.35 |
| ACD/KOC (pH 7.4): | 3666.12 |
| Polar Surface Area: | 17 Å2 |
| Polarizability: | 22.8±0.5 10-24cm3 |
| Surface Tension: | 39.3±5.0 dyne/cm |
| Molar Volume: | 185.6±5.0 cm3 |
Click to predict properties on the Chemicalize site
