ChemSpider 2D Image | (3S)-8-[(tert-butoxy)carbonyl]-2,8-diazaspiro[4.5]decane-3-carboxylic acid | C14H24N2O4

(3S)-8-[(tert-butoxy)carbonyl]-2,8-diazaspiro[4.5]decane-3-carboxylic acid

  • Molecular FormulaC14H24N2O4
  • Average mass284.351 Da
  • Monoisotopic mass284.173615 Da
  • ChemSpider ID71045996

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-8-[(tert-butoxy)carbonyl]-2,8-diazaspiro[4.5]decane-3-carboxylic acid
(3S)-8-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2,8-diazaspiro[4.5]decan-3-carbonsäure [German] [ACD/IUPAC Name]
(3S)-8-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2,8-diazaspiro[4.5]decane-3-carboxylic acid [ACD/IUPAC Name]
2,8-Diazaspiro[4.5]decane-3,8-dicarboxylic acid, 8-(1,1-dimethylethyl) ester, (3S)- [ACD/Index Name]
2306253-97-2 [RN]
Acide (3S)-8-{[(2-méthyl-2-propanyl)oxy]carbonyl}-2,8-diazaspiro[4.5]décane-3-carboxylique [French] [ACD/IUPAC Name]
(S)-8-(tert-Butoxycarbonyl)-2,8-diazaspiro[4.5]decane-3-carboxylic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 437.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±6.0 kJ/mol
Flash Point: 218.2±28.7 °C
Index of Refraction: 1.540
Molar Refractivity: 73.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.52
ACD/LogD (pH 5.5): -1.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 79 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 49.6±5.0 dyne/cm
Molar Volume: 235.4±5.0 cm3

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