ChemSpider 2D Image | 2-Amino-6-[(1R,2S)-1,2-dihydroxy(3,3,3-~2~H_3_)propyl]-7,8-dihydro-4(3H)-pteridinone | C9H10D3N5O3

2-Amino-6-[(1R,2S)-1,2-dihydroxy(3,3,3-2H3)propyl]-7,8-dihydro-4(3H)-pteridinone

  • Molecular FormulaC9H10D3N5O3
  • Average mass242.250 Da
  • Monoisotopic mass242.120667 Da
  • ChemSpider ID48061660

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2-Amino-6-[(1R,2S)-1,2-dihydroxy(3,3,3-2H3)propyl]-7,8-dihydro-4(3H)-pteridinon [German] [ACD/IUPAC Name]
2-Amino-6-[(1R,2S)-1,2-dihydroxy(3,3,3-2H3)propyl]-7,8-dihydro-4(3H)-pteridinone [ACD/IUPAC Name]
2-Amino-6-[(1R,2S)-1,2-dihydroxy(3,3,3-2H3)propyl]-7,8-dihydro-4(3H)-ptéridinone [French] [ACD/IUPAC Name]
4(3H)-Pteridinone, 2-amino-6-[(1R,2S)-1,2-dihydroxypropyl-3,3,3-d3]-7,8-dihydro- [ACD/Index Name]
1217782-44-9 [RN]
2-amino-6-[(1R,2S)-3,3,3-trideuterio-1,2-dihydroxypropyl]-7,8-dihydro-1H-pteridin-4-one
7,8-dihydro-l-biopterin-d3

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

    Density: 1.9±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.822
    Molar Refractivity: 55.4±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 6
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 1
    ACD/LogP: -3.39
    ACD/LogD (pH 5.5): -4.08
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 132 Å2
    Polarizability: 22.0±0.5 10-24cm3
    Surface Tension: 86.7±7.0 dyne/cm
    Molar Volume: 127.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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