ChemSpider 2D Image | (1R)-5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.3]hexane-1-carboxylic acid | C11H17NO4

(1R)-5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.3]hexane-1-carboxylic acid

  • Molecular FormulaC11H17NO4
  • Average mass227.257 Da
  • Monoisotopic mass227.115753 Da
  • ChemSpider ID114452140

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.3]hexan-1-carbonsäure [German] [ACD/IUPAC Name]
(1R)-5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.3]hexane-1-carboxylic acid [ACD/IUPAC Name]
5-Azaspiro[2.3]hexane-1,5-dicarboxylic acid, 5-(1,1-dimethylethyl) ester, (1R)- [ACD/Index Name]
Acide (1R)-5-{[(2-méthyl-2-propanyl)oxy]carbonyl}-5-azaspiro[2.3]hexane-1-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 362.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 66.9±6.0 kJ/mol
Flash Point: 173.2±25.9 °C
Index of Refraction: 1.542
Molar Refractivity: 56.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.30
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.01
ACD/LogD (pH 7.4): -2.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 50.2±5.0 dyne/cm
Molar Volume: 178.9±5.0 cm3

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