ChemSpider 2D Image | 3-(3,3-Difluorocyclobutyl)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanine | C12H19F2NO4

3-(3,3-Difluorocyclobutyl)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanine

  • Molecular FormulaC12H19F2NO4
  • Average mass279.280 Da
  • Monoisotopic mass279.128204 Da
  • ChemSpider ID34979942

More details:

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

3-(3,3-Difluorcyclobutyl)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanin [German] [ACD/IUPAC Name]
3-(3,3-Difluorocyclobutyl)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}alanine [ACD/IUPAC Name]
3-(3,3-Difluorocyclobutyl)-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}alanine [French] [ACD/IUPAC Name]
Cyclobutanepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-3,3-difluoro- [ACD/Index Name]
1629681-42-0 [RN]
2-((tert-Butoxycarbonyl)amino)-3-(3,3-difluorocyclobutyl)propanoic acid
2-((tert-butoxycarbonyl)amino)-3-(3,3-difluorocyclobutyl)propanoicacid
2-(tert-Butoxycarbonylamino)-3-(3,3-difluorocyclobutyl)propanoic acid
2-[(tert-butoxycarbonyl)amino]-3-(3,3-difluorocyclobutyl)propanoic acid
2-{[(tert-butoxy)carbonyl]amino}-3-(3,3-difluorocyclobutyl)propanoic 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: 394.5±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 70.7±6.0 kJ/mol
    Flash Point: 192.4±22.3 °C
    Index of Refraction: 1.469
    Molar Refractivity: 62.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.18
    ACD/LogD (pH 5.5): -0.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.44
    ACD/LogD (pH 7.4): -2.13
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 24.9±0.5 10-24cm3
    Surface Tension: 38.8±5.0 dyne/cm
    Molar Volume: 225.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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