ChemSpider 2D Image | 3-Methyl-1-(9-oxa-1-thia-4-azaspiro[5.5]undec-4-yl)-1-pentanone | C14H25NO2S

3-Methyl-1-(9-oxa-1-thia-4-azaspiro[5.5]undec-4-yl)-1-pentanone

  • Molecular FormulaC14H25NO2S
  • Average mass271.419 Da
  • Monoisotopic mass271.160614 Da
  • ChemSpider ID62268089

More details:

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

1-Pentanone, 3-methyl-1-(9-oxa-1-thia-4-azaspiro[5.5]undec-4-yl)- [ACD/Index Name]
3-Methyl-1-(9-oxa-1-thia-4-azaspiro[5.5]undec-4-yl)-1-pentanon [German] [ACD/IUPAC Name]
3-Methyl-1-(9-oxa-1-thia-4-azaspiro[5.5]undec-4-yl)-1-pentanone [ACD/IUPAC Name]
3-Méthyl-1-(9-oxa-1-thia-4-azaspiro[5.5]undéc-4-yl)-1-pentanone [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: 434.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.7±28.7 °C
Index of Refraction: 1.532
Molar Refractivity: 76.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 79.57
ACD/KOC (pH 5.5): 798.30
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 79.57
ACD/KOC (pH 7.4): 798.30
Polar Surface Area: 55 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 42.5±5.0 dyne/cm
Molar Volume: 246.9±5.0 cm3

Click to predict properties on the Chemicalize site


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