ChemSpider 2D Image | 1-{2-[4-(Benzyloxy)phenyl]-1,3-thiazolidin-3-yl}-2-ethyl-1-hexanone | C24H31NO2S

1-{2-[4-(Benzyloxy)phenyl]-1,3-thiazolidin-3-yl}-2-ethyl-1-hexanone

  • Molecular FormulaC24H31NO2S
  • Average mass397.573 Da
  • Monoisotopic mass397.207550 Da
  • ChemSpider ID22581695

More details:

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

1-{2-[4-(Benzyloxy)phenyl]-1,3-thiazolidin-3-yl}-2-ethyl-1-hexanon [German] [ACD/IUPAC Name]
1-{2-[4-(Benzyloxy)phenyl]-1,3-thiazolidin-3-yl}-2-ethyl-1-hexanone [ACD/IUPAC Name]
1-{2-[4-(Benzyloxy)phényl]-1,3-thiazolidin-3-yl}-2-éthyl-1-hexanone [French] [ACD/IUPAC Name]
1-Hexanone, 2-ethyl-1-[2-[4-(phenylmethoxy)phenyl]-3-thiazolidinyl]- [ACD/Index 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: 570.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 299.0±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 118.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.42
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20264.82
ACD/KOC (pH 5.5): 42106.82
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 20264.82
ACD/KOC (pH 7.4): 42106.82
Polar Surface Area: 55 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 358.8±3.0 cm3

Click to predict properties on the Chemicalize site


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