ChemSpider 2D Image | tert-butyl 3-thia-9-azaspiro[5.5]undecane-9-carboxylate | C14H25NO2S

tert-butyl 3-thia-9-azaspiro[5.5]undecane-9-carboxylate

  • Molecular FormulaC14H25NO2S
  • Average mass271.419 Da
  • Monoisotopic mass271.160614 Da
  • ChemSpider ID44209910

More details:

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

1782319-83-8 [RN]
2-Methyl-2-propanyl 3-thia-9-azaspiro[5.5]undecane-9-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-thia-9-azaspiro[5.5]undecan-9-carboxylat [German] [ACD/IUPAC Name]
3-Thia-9-azaspiro[5.5]undécane-9-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
3-Thia-9-azaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 3-thia-9-azaspiro[5.5]undecane-9-carboxylate
MFCD20486138

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

Density: 1.1±0.1 g/cm3
Boiling Point: 377.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 182.1±27.9 °C
Index of Refraction: 1.533
Molar Refractivity: 76.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 210.97
ACD/KOC (pH 5.5): 1604.28
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 210.97
ACD/KOC (pH 7.4): 1604.28
Polar Surface Area: 55 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 42.2±5.0 dyne/cm
Molar Volume: 246.7±5.0 cm3

Click to predict properties on the Chemicalize site


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