ChemSpider 2D Image | (2S)-2-Methoxy-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)butanoic acid | C10H19NO5

(2S)-2-Methoxy-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)butanoic acid

  • Molecular FormulaC10H19NO5
  • Average mass233.262 Da
  • Monoisotopic mass233.126328 Da
  • ChemSpider ID97396575

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Methoxy-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)butanoic acid [ACD/IUPAC Name]
(2S)-2-Methoxy-4-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)butansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-méthoxy-4-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-, (2S)- [ACD/Index Name]
(2S)-4-{[(tert-butoxy)carbonyl]amino}-2-methoxybutanoic acid
2348330-80-1 [RN]
MFCD32815189

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

Density: 1.1±0.1 g/cm3
Boiling Point: 394.8±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.8±6.0 kJ/mol
Flash Point: 192.6±25.1 °C
Index of Refraction: 1.462
Molar Refractivity: 57.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): -1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 207.3±3.0 cm3

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