Bromothymol blue C27H28Br2O5S structure – Flashcards
Flashcard maker : Suzette Hendon
Contents
| Molecular Formula | C27H28Br2O5S |
| Average mass | 624.381 Da |
| Density | 1.5±0.1 g/cm3 |
| Boiling Point | 614.3±55.0 °C at 760 mmHg |
| Flash Point | 325.3±31.5 °C |
| Molar Refractivity | 144.8±0.4 cm3 |
| Polarizability | 57.4±0.5 10-24cm3 |
| Surface Tension | 54.1±3.0 dyne/cm |
| Molar Volume | 404.9±3.0 cm3 |
- Experimental data
- Predicted – ACD/Labs
- Predicted – ChemAxon
- Predicted – Mcule
- Experimental Physico-chemical Properties
- Miscellaneous
Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module
| Density: | 1.5±0.1 g/cm3 |
| Boiling Point: | 614.3±55.0 °C at 760 mmHg |
| Vapour Pressure: | 0.0±1.8 mmHg at 25°C |
| Enthalpy of Vaporization: | 94.5±3.0 kJ/mol |
| Flash Point: | 325.3±31.5 °C |
| Index of Refraction: | 1.634 |
| Molar Refractivity: | 144.8±0.4 cm3 |
| #H bond acceptors: | 5 |
| #H bond donors: | 2 |
| #Freely Rotating Bonds: | 4 |
| #Rule of 5 Violations: | 2 |
| ACD/LogP: | 8.60 |
| ACD/LogD (pH 5.5): | 7.90 |
| ACD/BCF (pH 5.5): | 575174.94 |
| ACD/KOC (pH 5.5): | 440905.75 |
| ACD/LogD (pH 7.4): | 6.27 |
| ACD/BCF (pH 7.4): | 13411.26 |
| ACD/KOC (pH 7.4): | 10280.53 |
| Polar Surface Area: | 92 Å2 |
| Polarizability: | 57.4±0.5 10-24cm3 |
| Surface Tension: | 54.1±3.0 dyne/cm |
| Molar Volume: | 404.9±3.0 cm3 |
Click to predict properties on the Chemicalize site
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- 1-Click Scaffold Hop
