ChemSpider 2D Image | (2R,3S)-3-Hydroxy-4-methyl-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentanoic acid (non-preferred name) | C11H21NO5

(2R,3S)-3-Hydroxy-4-methyl-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentanoic acid (non-preferred name)

  • Molecular FormulaC11H21NO5
  • Average mass247.288 Da
  • Monoisotopic mass247.141968 Da
  • ChemSpider ID29312282

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3S)-3-Hydroxy-4-methyl-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentanoic acid (non-preferred name) [ACD/IUPAC Name]
(2R,3S)-3-Hydroxy-4-methyl-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)pentansäure [German] [ACD/IUPAC Name]
Acide (2R,3S)-3-hydroxy-4-méthyl-2-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)pentanoïque [French] [ACD/IUPAC Name]
(2R,3S)-2-((tert-Butoxycarbonyl)amino)-3-hydroxy-4-methylpentanoic acid
(2R,3S)-2-[(tert-butoxycarbonyl)amino]-3-hydroxy-4-methylpentanoic acid
(2R,3S)-2-{[(tert-butoxy)carbonyl]amino}-3-hydroxy-4-methylpentanoic acid
(2R,3S)-3-hydroxy-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
(2s,3r)-2-(boc-amino)-3-hydroxy-4-methylpentanoic??acid
(3S)?-N-?[(1,?1-?dimethylethoxy)?carbonyl]?-?3-?hydroxy-?D-?Leucine
[102507-17-5] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 402.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 75.6±6.0 kJ/mol
    Flash Point: 197.4±27.3 °C
    Index of Refraction: 1.480
    Molar Refractivity: 61.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.44
    ACD/LogD (pH 5.5): -1.24
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.54
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 96 Å2
    Polarizability: 24.3±0.5 10-24cm3
    Surface Tension: 41.7±3.0 dyne/cm
    Molar Volume: 215.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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