ChemSpider 2D Image | Methyl 21-hydroxyhenicosanoate | C22H44O3

Methyl 21-hydroxyhenicosanoate

  • Molecular FormulaC22H44O3
  • Average mass356.583 Da
  • Monoisotopic mass356.329041 Da
  • ChemSpider ID26324046

More details:

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

21-Hydroxyhénicosanoate de méthyle [French] [ACD/IUPAC Name]
94035-98-0 [RN]
Heneicosanoic acid, 21-hydroxy-, methyl ester [ACD/Index Name]
Methyl 21-hydroxyhenicosanoate [ACD/IUPAC Name]
Methyl-21-hydroxyhenicosanoat [German] [ACD/IUPAC Name]
21-hydroxy Heneicosanoic Acid methyl ester
21-hydroxy-heneicosanoic acid, methyl ester
METHYL 21-HYDROXYHENEICOSANOATE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 445.8±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±6.0 kJ/mol
Flash Point: 163.1±14.0 °C
Index of Refraction: 1.459
Molar Refractivity: 107.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 1
ACD/LogP: 8.27
ACD/LogD (pH 5.5): 7.43
ACD/BCF (pH 5.5): 259178.53
ACD/KOC (pH 5.5): 260992.98
ACD/LogD (pH 7.4): 7.43
ACD/BCF (pH 7.4): 259178.53
ACD/KOC (pH 7.4): 260992.98
Polar Surface Area: 47 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 392.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement