ChemSpider 2D Image | N~5~-{Bis[(~2~H_3_)methylamino]methylene}-L-ornithine | C8H12D6N4O2

N5-{Bis[(2H3)methylamino]methylene}-L-ornithine

  • Molecular FormulaC8H12D6N4O2
  • Average mass208.291 Da
  • Monoisotopic mass208.180634 Da
  • ChemSpider ID23976267

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

L-Ornithine, N5-[bis(methyl-d3-amino)methylene]- [ACD/Index Name]
N5-{Bis[(2H3)methylamino]methylen}-L-ornithin [German] [ACD/IUPAC Name]
N5-{Bis[(2H3)methylamino]methylene}-L-ornithine [ACD/IUPAC Name]
N5-{Bis[(2H3)méthylamino]méthylène}-L-ornithine [French] [ACD/IUPAC Name]
(2S)-2-amino-5-[bis(trideuteriomethylamino)methylideneamino]pentanoic acid
1331888-08-4 [RN]
30344-00-4 [RN]
ng,ng???-dimethyl-l-arginine-d6
ng,ng’-dimethyl-l-arginine-d6

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 353.5±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 65.8±6.0 kJ/mol
    Flash Point: 167.6±30.7 °C
    Index of Refraction: 1.540
    Molar Refractivity: 51.8±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 5
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: -0.62
    ACD/LogD (pH 5.5): -4.27
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 100 Å2
    Polarizability: 20.5±0.5 10-24cm3
    Surface Tension: 44.3±7.0 dyne/cm
    Molar Volume: 165.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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