CSID:62472, http://www.julianum.net/Chemical-Structure.62472.html (accessed 00:12, Nov 12, 2021) CopyCopied
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speculative Physico-chemical properties guess Physico-chemical nature assorted Gas chromatography
| Density: | 1.3±0.1 g/cm3 |
| Boiling Point: | 284.7±13.0 °C at 760 mmHg |
| Vapour Pressure: | 0.0±0.6 mmHg at 25°C |
| Enthalpy that Vaporization: | 52.4±3.0 kJ/mol |
| Flash Point: | 136.8±21.8 °C |
| Index the Refraction: | 1.554 |
| Molar Refractivity: | 44.6±0.3 cm3 |
| #H link acceptors: | 5 |
| #H link donors: | 0 |
| #Freely Rotating Bonds: | 3 |
| #Rule of 5 Violations: | 0 |
| ACD/LogP: | 1.82 |
| ACD/LogD (pH 5.5): | 1.91 |
| ACD/BCF (pH 5.5): | 16.75 |
| ACD/KOC (pH 5.5): | 261.74 |
| ACD/LogD (pH 7.4): | 1.91 |
| ACD/BCF (pH 7.4): | 16.75 |
| ACD/KOC (pH 7.4): | 261.74 |
| Polar surface Area: | 72 Å2 |
| Polarizability: | 17.7±0.5 10-24cm3 |
| Surface Tension: | 48.7±3.0 dyne/cm |
| Molar Volume: | 139.2±3.0 cm3 |
Predicted data is produced using the US environmental Protection Agency’s EPISuite™
log Octanol-Water Partition Coef (SRC): log in Kow (KOWWIN v1.67 estimate) = 1.65 log Kow (Exper. Database match) = 1.89 Exper. Ref: Sotomatsu,T et al. (1993) boil Pt, melting Pt, Vapor push Estimations (MPBPWIN v1.42): boiling Pt (deg C): 281.95 (Adapted Stein & Brown method) melting Pt (deg C): 71.14 (Mean or load MP) VP(mm Hg,25 deg C): 0.00159 (Modified serial method) MP (exp database): 78 deg C BP (exp database): 279
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