ChemSpider 2D Image | 74-Methyl-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxapentaheptacontan-1-ol | C56H114O21

74-Methyl-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxapentaheptacontan-1-ol

  • Molecular FormulaC56H114O21
  • Average mass1123.492 Da
  • Monoisotopic mass1122.785278 Da
  • ChemSpider ID9369167

More details:

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

3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-Eicosaoxapentaheptacontan-1-ol, 74-methyl- [ACD/Index Name]
74-Methyl-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxapentaheptacontan-1-ol [ACD/IUPAC Name]
74-Methyl-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxapentaheptacontan-1-ol [German] [ACD/IUPAC Name]
74-Méthyl-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60-icosaoxapentaheptacontan-1-ol [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 924.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 152.6±6.0 kJ/mol
Flash Point: 512.8±32.9 °C
Index of Refraction: 1.465
Molar Refractivity: 297.9±0.3 cm3
#H bond acceptors: 21
#H bond donors: 1
#Freely Rotating Bonds: 73
#Rule of 5 Violations: 2
ACD/LogP: 0.18
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 276.93
ACD/KOC (pH 5.5): 1949.19
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 276.93
ACD/KOC (pH 7.4): 1949.19
Polar Surface Area: 205 Å2
Polarizability: 118.1±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 1078.0±3.0 cm3

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