ChemSpider 2D Image | 3-Cyclobutylalanine | C7H13NO2

3-Cyclobutylalanine

  • Molecular FormulaC7H13NO2
  • Average mass143.184 Da
  • Monoisotopic mass143.094635 Da
  • ChemSpider ID24958149

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-2-Amino-3-cyclobutylpropanoic acid
1201593-65-8 [RN]
3-Cyclobutylalanin [German] [ACD/IUPAC Name]
3-Cyclobutylalanine [ACD/IUPAC Name]
3-Cyclobutylalanine [French] [ACD/IUPAC Name]
3-Cyclobutyl-L-alanine
Cyclobutanepropanoic acid, α-amino-, (αS)- [ACD/Index Name]
(2S)-2-AMINO-3-CYCLOBUTYLPROPANOIC ACID
(S)-2-Amino-3-cyclobutylpropanoicacid
(S)-2-Amino-3-cyclobutyl-propionic 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: 1.2±0.1 g/cm3
    Boiling Point: 274.0±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 56.4±6.0 kJ/mol
    Flash Point: 119.5±22.6 °C
    Index of Refraction: 1.518
    Molar Refractivity: 37.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.78
    ACD/LogD (pH 5.5): -1.70
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.70
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 63 Å2
    Polarizability: 14.9±0.5 10-24cm3
    Surface Tension: 52.0±3.0 dyne/cm
    Molar Volume: 123.7±3.0 cm3

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