ChemSpider 2D Image | 2-Methyl-8-(2-methyl-2-propanyl)-4-(4-phenoxyphenyl)-1-thia-4-azaspiro[4.5]decan-3-one | C25H31NO2S

2-Methyl-8-(2-methyl-2-propanyl)-4-(4-phenoxyphenyl)-1-thia-4-azaspiro[4.5]decan-3-one

  • Molecular FormulaC25H31NO2S
  • Average mass409.584 Da
  • Monoisotopic mass409.207550 Da
  • ChemSpider ID24755822

More details:

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

1-Thia-4-azaspiro[4.5]decan-3-one, 8-(1,1-dimethylethyl)-2-methyl-4-(4-phenoxyphenyl)- [ACD/Index Name]
2-Methyl-8-(2-methyl-2-propanyl)-4-(4-phenoxyphenyl)-1-thia-4-azaspiro[4.5]decan-3-on [German] [ACD/IUPAC Name]
2-Methyl-8-(2-methyl-2-propanyl)-4-(4-phenoxyphenyl)-1-thia-4-azaspiro[4.5]decan-3-one [ACD/IUPAC Name]
2-Méthyl-8-(2-méthyl-2-propanyl)-4-(4-phénoxyphényl)-1-thia-4-azaspiro[4.5]décan-3-one [French] [ACD/IUPAC Name]
8-(tert-butyl)-3-methyl-1-(4-phenoxyphenyl)-4-thia-1-azaspiro[4.5]decan-2-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 590.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 310.8±28.7 °C
Index of Refraction: 1.611
Molar Refractivity: 121.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.36
ACD/LogD (pH 5.5): 6.48
ACD/BCF (pH 5.5): 49806.95
ACD/KOC (pH 5.5): 80149.46
ACD/LogD (pH 7.4): 6.48
ACD/BCF (pH 7.4): 49807.61
ACD/KOC (pH 7.4): 80150.52
Polar Surface Area: 55 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 349.3±5.0 cm3

Click to predict properties on the Chemicalize site


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