ChemSpider 2D Image | (3-Cyclohexyl)propyl 5-(1,3-dioxolan-2-yl)-2-thienyl ketone | C17H24O3S

(3-Cyclohexyl)propyl 5-(1,3-dioxolan-2-yl)-2-thienyl ketone

  • Molecular FormulaC17H24O3S
  • Average mass308.436 Da
  • Monoisotopic mass308.144623 Da
  • ChemSpider ID21398163

More details:

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

(3-Cyclohexyl)propyl 5-(1,3-dioxolan-2-yl)-2-thienyl ketone
1-Butanone, 4-cyclohexyl-1-[5-(1,3-dioxolan-2-yl)-2-thienyl]- [ACD/Index Name]
4-Cyclohexyl-1-[5-(1,3-dioxolan-2-yl)-2-thienyl]-1-butanon [German] [ACD/IUPAC Name]
4-Cyclohexyl-1-[5-(1,3-dioxolan-2-yl)-2-thienyl]-1-butanone [ACD/IUPAC Name]
4-Cyclohexyl-1-[5-(1,3-dioxolan-2-yl)-2-thiényl]-1-butanone [French] [ACD/IUPAC Name]
898772-76-4 [RN]
4-cyclohexyl-1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]butan-1-one
97%
MFCD07699103 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 461.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 233.1±28.7 °C
Index of Refraction: 1.537
Molar Refractivity: 84.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 921.01
ACD/KOC (pH 5.5): 4607.01
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 921.01
ACD/KOC (pH 7.4): 4607.01
Polar Surface Area: 64 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 271.5±3.0 cm3

Click to predict properties on the Chemicalize site


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