原文由 lololol(v2727998) 发表:
Tocopherol Succinate
Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.
ACD/LogP: 10.159 # of Rule of 5Violations: 2 ACD/LogD (pH 5.5): 8.98 ACD/LogD (pH 7.4): 7.19 ACD/BCF (pH 5.5): 1000000.00 ACD/BCF (pH 7.4): 33247.36 ACD/KOC (pH 5.5): 533830.80 ACD/KOC (pH 7.4): 8597.75 #H bond acceptors: 5 #H bond donors: 1 #Freely Rotating Bonds: 17 Polar Surface Area: 72.83 Å2 Index of Refraction: 1.498 Molar Refractivity: 155.355 cm3 Molar Volume: 529.618 cm3 Polarizability: 61.587 10-24cm3 Surface Tension: 37.5320014953613 dyne/cm Density: 1.002 g/cm3 Flash Point: 186.97 °C Enthalpy of Vaporization: 97.392 kJ/mol Boiling Point: 625.837 °C at 760 mmHg Vapour Pressure: 0 mmHg at 25°C
这是个计算值,参考一下吧
原文由 xiaowang268(xiaowang268) 发表:原文由 lololol(v2727998) 发表:
Tocopherol Succinate
Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.
ACD/LogP: 10.159 # of Rule of 5Violations: 2 ACD/LogD (pH 5.5): 8.98 ACD/LogD (pH 7.4): 7.19 ACD/BCF (pH 5.5): 1000000.00 ACD/BCF (pH 7.4): 33247.36 ACD/KOC (pH 5.5): 533830.80 ACD/KOC (pH 7.4): 8597.75 #H bond acceptors: 5 #H bond donors: 1 #Freely Rotating Bonds: 17 Polar Surface Area: 72.83 Å2 Index of Refraction: 1.498 Molar Refractivity: 155.355 cm3 Molar Volume: 529.618 cm3 Polarizability: 61.587 10-24cm3 Surface Tension: 37.5320014953613 dyne/cm Density: 1.002 g/cm3 Flash Point: 186.97 °C Enthalpy of Vaporization: 97.392 kJ/mol Boiling Point: 625.837 °C at 760 mmHg Vapour Pressure: 0 mmHg at 25°C
这是个计算值,参考一下吧
这些数据是来自?
原文由 lololol(v2727998) 发表:原文由 xiaowang268(xiaowang268) 发表:原文由 lololol(v2727998) 发表:
Tocopherol Succinate
Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.
ACD/LogP: 10.159 # of Rule of 5Violations: 2 ACD/LogD (pH 5.5): 8.98 ACD/LogD (pH 7.4): 7.19 ACD/BCF (pH 5.5): 1000000.00 ACD/BCF (pH 7.4): 33247.36 ACD/KOC (pH 5.5): 533830.80 ACD/KOC (pH 7.4): 8597.75 #H bond acceptors: 5 #H bond donors: 1 #Freely Rotating Bonds: 17 Polar Surface Area: 72.83 Å2 Index of Refraction: 1.498 Molar Refractivity: 155.355 cm3 Molar Volume: 529.618 cm3 Polarizability: 61.587 10-24cm3 Surface Tension: 37.5320014953613 dyne/cm Density: 1.002 g/cm3 Flash Point: 186.97 °C Enthalpy of Vaporization: 97.392 kJ/mol Boiling Point: 625.837 °C at 760 mmHg Vapour Pressure: 0 mmHg at 25°C
这是个计算值,参考一下吧
这些数据是来自?
chemspider