ChemSpider 2D Image | Mosedipimod | C39H70O6


  • Molecular FormulaC39H70O6
  • Average mass634.969 Da
  • Monoisotopic mass634.517212 Da
  • ChemSpider ID8136532
  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(9Z,12Z)-9,12-Octadécadiénoate de 1-acétoxy-3-(palmitoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
1-(acetyloxy)-3-(hexadecanoyloxy)propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
1-Acetoxy-3-(palmitoyloxy)-2-propanyl (9Z,12Z)-9,12-octadecadienoate [ACD/IUPAC Name]
1-Acetoxy-3-(palmitoyloxy)-2-propanyl-(9Z,12Z)-9,12-octadecadienoat [German] [ACD/IUPAC Name]
221139-79-3 [RN]
9,12-Octadecadienoic acid, 2-(acetyloxy)-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester, (9Z,12Z)- [ACD/Index Name]
mosedipimod [Spanish] [INN]
Mosedipimod [INN]
mosédipimod [French] [INN]
mosedipimodum [Latin] [INN]

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

88928BS57E [DBID]
EC-18 [DBID]
UNII:88928BS57E [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 650.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 257.4±26.0 °C
Index of Refraction: 1.473
Molar Refractivity: 188.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 2
ACD/LogP: 14.67
ACD/LogD (pH 5.5): 13.70
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.70
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 74.6±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 670.4±3.0 cm3

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