ChemSpider 2D Image | BOC-D-2-AMINOSUBERIC ACID | C13H23NO6

BOC-D-2-AMINOSUBERIC ACID

  • Molecular FormulaC13H23NO6
  • Average mass289.325 Da
  • Monoisotopic mass289.152527 Da
  • ChemSpider ID21756851

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)octandisäure [German] [ACD/IUPAC Name]
(2R)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)octanedioic acid [ACD/IUPAC Name]
(2R)-2-{[(TERT-BUTOXY)CARBONYL]AMINO}OCTANEDIOIC ACID
(R)-2-(Boc-amino)octanedioic acid
75113-71-2 [RN]
Acide (2R)-2-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)octanedioïque [French] [ACD/IUPAC Name]
BOC-D-2-AMINOSUBERIC ACID
MFCD01317723 [MDL number]
Octanedioic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2R)- [ACD/Index Name]
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]octanedioic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 486.1±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 82.3±6.0 kJ/mol
    Flash Point: 247.8±27.3 °C
    Index of Refraction: 1.489
    Molar Refractivity: 70.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 1.65
    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): -3.27
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 113 Å2
    Polarizability: 28.0±0.5 10-24cm3
    Surface Tension: 45.9±3.0 dyne/cm
    Molar Volume: 245.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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