ChemSpider 2D Image | 1,3-Dihydroxy-2-propanyl heptadecanoate | C20H40O4

1,3-Dihydroxy-2-propanyl heptadecanoate

  • Molecular FormulaC20H40O4
  • Average mass344.529 Da
  • Monoisotopic mass344.292664 Da
  • ChemSpider ID59693721

More details:

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

1,3-Dihydroxy-2-propanyl heptadecanoate [ACD/IUPAC Name]
1,3-Dihydroxy-2-propanyl-heptadecanoat [German] [ACD/IUPAC Name]
Heptadécanoate de 1,3-dihydroxy-2-propanyle [French] [ACD/IUPAC Name]
Heptadecanoic acid, 2-hydroxy-1-(hydroxymethyl)ethyl ester [ACD/Index Name]
1,3-dihydroxypropan-2-yl heptadecanoate
MG(0:0/17:0/0:0)

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 473.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 84.9±6.0 kJ/mol
Flash Point: 153.2±16.7 °C
Index of Refraction: 1.469
Molar Refractivity: 99.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 6.93
ACD/LogD (pH 5.5): 6.47
ACD/BCF (pH 5.5): 48643.53
ACD/KOC (pH 5.5): 78805.21
ACD/LogD (pH 7.4): 6.47
ACD/BCF (pH 7.4): 48643.48
ACD/KOC (pH 7.4): 78805.13
Polar Surface Area: 67 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 357.5±3.0 cm3

Click to predict properties on the Chemicalize site


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