ChemSpider 2D Image | (2S)-2-({Hydroxy[(2-methyl-2-propanyl)oxy]methylene}amino)dodecanoic acid | C17H33NO4

(2S)-2-({Hydroxy[(2-methyl-2-propanyl)oxy]methylene}amino)dodecanoic acid

  • Molecular FormulaC17H33NO4
  • Average mass315.448 Da
  • Monoisotopic mass315.240967 Da
  • ChemSpider ID57262100

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-({Hydroxy[(2-methyl-2-propanyl)oxy]methylen}amino)dodecansäure [German] [ACD/IUPAC Name]
(2S)-2-({Hydroxy[(2-methyl-2-propanyl)oxy]methylene}amino)dodecanoic acid [ACD/IUPAC Name]
Acide (2S)-2-({hydroxy[(2-méthyl-2-propanyl)oxy]méthylène}amino)dodécanoïque [French] [ACD/IUPAC Name]
Dodecanoic acid, 2-[[(1,1-dimethylethoxy)hydroxymethylene]amino]-, (2S)- [ACD/Index Name]
(2S)-2-(Boc-amino)dodecanoic acid
146276-04-2 [RN]
BOC-ADOD(2)-OH
Boc-L-2Ado-OH
Boc-S-2-amino-Dodecanoic acid
Dodecanoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2S)-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 430.0±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.1±6.0 kJ/mol
    Flash Point: 213.8±29.3 °C
    Index of Refraction: 1.475
    Molar Refractivity: 87.7±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 1
    ACD/LogP: 6.36
    ACD/LogD (pH 5.5): 2.78
    ACD/BCF (pH 5.5): 17.12
    ACD/KOC (pH 5.5): 45.29
    ACD/LogD (pH 7.4): 1.97
    ACD/BCF (pH 7.4): 2.64
    ACD/KOC (pH 7.4): 6.99
    Polar Surface Area: 79 Å2
    Polarizability: 34.8±0.5 10-24cm3
    Surface Tension: 34.0±7.0 dyne/cm
    Molar Volume: 311.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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