ChemSpider 2D Image | DIHEPTADECANOIN | C37H72O5

DIHEPTADECANOIN

  • Molecular FormulaC37H72O5
  • Average mass596.965 Da
  • Monoisotopic mass596.537964 Da
  • ChemSpider ID14392346

More details:

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

1,3-Diheptadecanoyl Glycerol
121957-72-0 [RN]
2-Hydroxy-1,3-propandiyl-diheptadecanoat [German] [ACD/IUPAC Name]
2-Hydroxy-1,3-propanediyl diheptadecanoate [ACD/IUPAC Name]
71431-35-1 [RN]
Diheptadécanoate de 2-hydroxy-1,3-propanediyle [French] [ACD/IUPAC Name]
DIHEPTADECANOIN
Heptadecanoic acid, 2-hydroxy-1,3-propanediyl ester [ACD/Index Name]
(3-Heptadecanoyloxy-2-hydroxypropyl) heptadecanoate
1,1′-(2-hydroxy-1,3-propanediyl) ester, heptadecanoic acid
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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: 0.9±0.0 g/cm3
Boiling Point: 649.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 109.6±0.0 kJ/mol
Flash Point: 181.2±0.0 °C
Index of Refraction: 1.466
Molar Refractivity: 178.5±0.0 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 2
ACD/LogP: 14.98
ACD/LogD (pH 5.5): 14.98
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.98
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 70.8±0.0 10-24cm3
Surface Tension: 35.1±0.0 dyne/cm
Molar Volume: 644.1±0.0 cm3

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