ChemSpider 2D Image | Methyl 2-(1,9-dioxa-4-azaspiro[5.5]undec-4-ylmethyl)-2-hydroxyoctanoate | C18H33NO5

Methyl 2-(1,9-dioxa-4-azaspiro[5.5]undec-4-ylmethyl)-2-hydroxyoctanoate

  • Molecular FormulaC18H33NO5
  • Average mass343.458 Da
  • Monoisotopic mass343.235870 Da
  • ChemSpider ID65054363

More details:

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

1,9-Dioxa-4-azaspiro[5.5]undecane-4-propanoic acid, α-hexyl-α-hydroxy-, methyl ester [ACD/Index Name]
2-(1,9-Dioxa-4-azaspiro[5.5]undéc-4-ylméthyl)-2-hydroxyoctanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-(1,9-dioxa-4-azaspiro[5.5]undec-4-ylmethyl)-2-hydroxyoctanoate [ACD/IUPAC Name]
Methyl-2-(1,9-dioxa-4-azaspiro[5.5]undec-4-ylmethyl)-2-hydroxyoctanoat [German] [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: 480.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.9±6.0 kJ/mol
Flash Point: 244.5±28.7 °C
Index of Refraction: 1.511
Molar Refractivity: 92.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 1.92
ACD/BCF (pH 5.5): 6.24
ACD/KOC (pH 5.5): 39.20
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 221.15
ACD/KOC (pH 7.4): 1390.28
Polar Surface Area: 68 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 44.6±5.0 dyne/cm
Molar Volume: 307.4±5.0 cm3

Click to predict properties on the Chemicalize site


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