ChemSpider 2D Image | S-propargyl-cysteine | C6H9NO2S

S-propargyl-cysteine

  • Molecular FormulaC6H9NO2S
  • Average mass159.206 Da
  • Monoisotopic mass159.035400 Da
  • ChemSpider ID18501933

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3262-64-4 [RN]
L-Cysteine, S-2-propyn-1-yl- [ACD/Index Name]
S-2-Propin-1-yl-L-cystein [German] [ACD/IUPAC Name]
S-2-Propyn-1-yl-L-cysteine [ACD/IUPAC Name]
S-2-Propyn-1-yl-L-cystéine [French] [ACD/IUPAC Name]
S-Prop-2-yn-1-yl-L-cysteine
S-propargyl-cysteine
(2R)-2-amino-3-(prop-2-yn-1-ylsulfanyl)propanoic acid
(l)-3-(propargylsulfenyl)-alanine
(R )-2-AMINO-3-(PROP-2-YNYLTHIO)PROPANOIC ACID[3262-64-4]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 294.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 58.8±6.0 kJ/mol
    Flash Point: 132.1±27.3 °C
    Index of Refraction: 1.571
    Molar Refractivity: 40.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 3
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.01
    ACD/LogD (pH 5.5): -1.75
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.80
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 89 Å2
    Polarizability: 16.1±0.5 10-24cm3
    Surface Tension: 62.6±3.0 dyne/cm
    Molar Volume: 124.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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