Found 1 result

Search term: 121227-20-1 (Found by synonym)
ChemSpider 2D Image | (1S,2S)-2-{[(Benzyloxy)carbonyl]amino}cyclobutanecarboxylic acid | C13H15NO4

(1S,2S)-2-{[(Benzyloxy)carbonyl]amino}cyclobutanecarboxylic acid

  • Molecular FormulaC13H15NO4
  • Average mass249.262 Da
  • Monoisotopic mass249.100113 Da
  • ChemSpider ID24784632

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2S)-2-{[(Benzyloxy)carbonyl]amino}cyclobutancarbonsäure [German] [ACD/IUPAC Name]
(1S,2S)-2-{[(Benzyloxy)carbonyl]amino}cyclobutanecarboxylic acid [ACD/IUPAC Name]
Acide (1S,2S)-2-{[(benzyloxy)carbonyl]amino}cyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 2-[[(phenylmethoxy)carbonyl]amino]-, (1S,2S)- [ACD/Index Name]
(1S,2S)-2-(((benzyloxy)carbonyl)amino)cyclobutanecarboxylic acid
(1S,2S)-2-{[(Benzyloxy)carbonyl]amino}cyclobutane-1-carboxylic acid
121227-20-1 [RN]
1212272-03-1 [RN]
MFCD03844619 [MDL number]
SS-2556
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 464.9±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.5±3.0 kJ/mol
    Flash Point: 234.9±28.4 °C
    Index of Refraction: 1.580
    Molar Refractivity: 64.2±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.52
    ACD/LogD (pH 5.5): 0.68
    ACD/BCF (pH 5.5): 1.06
    ACD/KOC (pH 5.5): 17.84
    ACD/LogD (pH 7.4): -1.12
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 25.5±0.5 10-24cm3
    Surface Tension: 55.3±5.0 dyne/cm
    Molar Volume: 193.1±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement