ChemSpider 2D Image | MFCD11053524 | C12H21NO5

MFCD11053524

  • Molecular FormulaC12H21NO5
  • Average mass259.299 Da
  • Monoisotopic mass259.141968 Da
  • ChemSpider ID24957938

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-6,6-Dimethyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-morpholincarbonsäure [German] [ACD/IUPAC Name]
(3S)-6,6-Dimethyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-morpholinecarboxylic acid [ACD/IUPAC Name]
(S)-4-(tert-butoxycarbonyl)-6,6-dimethylmorpholine-3-carboxylic acid
(S)-4-Boc-6,6-Dimethyl-morpholine-3-carboxylic acid
3,4-Morpholinedicarboxylic acid, 6,6-dimethyl-, 4-(1,1-dimethylethyl) ester, (3S)- [ACD/Index Name]
4-(1,1-Dimethylethyl) (3S)-6,6-dimethyl-3,4-morpholinedicarboxylate
783349-78-0 [RN]
Acide (3S)-6,6-diméthyl-4-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-morpholinecarboxylique [French] [ACD/IUPAC Name]
MFCD11053524
(3S)-4-(tert-Butoxycarbonyl)-6,6-dimethylmorpholine-3-carboxylic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 374.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 68.2±6.0 kJ/mol
    Flash Point: 180.0±27.9 °C
    Index of Refraction: 1.476
    Molar Refractivity: 63.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.26
    ACD/LogD (pH 5.5): -0.55
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.54
    ACD/LogD (pH 7.4): -2.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 25.3±0.5 10-24cm3
    Surface Tension: 39.1±3.0 dyne/cm
    Molar Volume: 226.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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