ChemSpider 2D Image | (~2~H_5_)-1,2,3-Propanetriyl tributanoate | C15H21D5O6

(2H5)-1,2,3-Propanetriyl tributanoate

  • Molecular FormulaC15H21D5O6
  • Average mass307.394 Da
  • Monoisotopic mass307.204315 Da
  • ChemSpider ID107433855

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H5)-1,2,3-Propanetriyl tributanoate [ACD/IUPAC Name]
(2H5)-1,2,3-Propantriyl-tributanoat [German] [ACD/IUPAC Name]
Butanoic acid, 1,2,3-propanetriyl-d5 ester [ACD/Index Name]
Tributanoate de (2H5)-1,2,3-propanetriyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 307.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 173.9±0.0 °C
Index of Refraction: 1.448
Molar Refractivity: 76.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 107.88
ACD/KOC (pH 5.5): 992.65
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 107.88
ACD/KOC (pH 7.4): 992.65
Polar Surface Area: 79 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 287.0±3.0 cm3

Click to predict properties on the Chemicalize site


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