ChemSpider 2D Image | (2S)-1,2-Propanediyl dibenzoate | C17H16O4

(2S)-1,2-Propanediyl dibenzoate

  • Molecular FormulaC17H16O4
  • Average mass284.306 Da
  • Monoisotopic mass284.104858 Da
  • ChemSpider ID34990334

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1,2-Propandiyl-dibenzoat [German] [ACD/IUPAC Name]
(2S)-1,2-Propanediyl dibenzoate [ACD/IUPAC Name]
1,2-Propanediol, dibenzoate, (2S)- [ACD/Index Name]
Dibenzoate de (2S)-1,2-propanediyle [French] [ACD/IUPAC Name]
(s)-1,2-propanediyl dibenzoate
19224-26-1 [RN]
242-894-7 [EINECS]
PROPYLENE GLYCOL DIBENZOATE
UNII-EQY32Z1AN4

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

Density: 1.2±0.1 g/cm3
Boiling Point: 385.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.4±3.0 kJ/mol
Flash Point: 206.7±22.4 °C
Index of Refraction: 1.560
Molar Refractivity: 78.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.83
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 913.73
ACD/KOC (pH 5.5): 4580.93
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 913.73
ACD/KOC (pH 7.4): 4580.93
Polar Surface Area: 53 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 243.0±3.0 cm3

Click to predict properties on the Chemicalize site


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