ChemSpider 2D Image | (~2~H_7_)-2-Propanyl salicylate | C10H5D7O3

(2H7)-2-Propanyl salicylate

  • Molecular FormulaC10H5D7O3
  • Average mass187.244 Da
  • Monoisotopic mass187.122574 Da
  • ChemSpider ID128917700

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H7)-2-Propanyl salicylate [ACD/IUPAC Name]
(2H7)-2-Propanylsalicylat [German] [ACD/IUPAC Name]
Benzoic acid, 2-hydroxy-, 1-(methyl-d3)ethyl-1,2,2,2-d4 ester [ACD/Index Name]
Salicylate de (2H7)-2-propanyle [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: 241.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.7±3.0 kJ/mol
Flash Point: 96.5±12.6 °C
Index of Refraction: 1.530
Molar Refractivity: 49.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 186.13
ACD/KOC (pH 5.5): 1466.16
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 168.25
ACD/KOC (pH 7.4): 1325.30
Polar Surface Area: 47 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 159.1±3.0 cm3

Click to predict properties on the Chemicalize site


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