ChemSpider 2D Image | 4-Chloro-7-(2-deoxy-alpha-D-erythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine | C11H13ClN4O3

4-Chloro-7-(2-deoxy-α-D-erythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine

  • Molecular FormulaC11H13ClN4O3
  • Average mass284.699 Da
  • Monoisotopic mass284.067627 Da
  • ChemSpider ID32077025

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

4-Chlor-7-(2-desoxy-α-D-erythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amin [German] [ACD/IUPAC Name]
4-Chloro-7-(2-deoxy-α-D-erythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine [ACD/IUPAC Name]
4-Chloro-7-(2-désoxy-α-D-érythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidin-2-amine, 4-chloro-7-(2-deoxy-α-D-erythro-pentofuranosyl)- [ACD/Index Name]
(2R,3S,5S)-5-(2-amino-4-chloropyrrolo[2,3-d]pyrimidin-7-yl)-2-(hydroxymethyl)oxolan-3-ol
(2R,3S,5S)-5-{2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl}-2-(hydroxymethyl)oxolan-3-ol
(2R,3S,5S)-5-{2-amino-4-chloropyrrolo[2,3-d]pyrimidin-7-yl}-2-(hydroxymethyl)oxolan-3-ol
104291-17-0 [RN]
7-Deaza-4-Cl-2???dG
7-Deaza-4-Cl-2???-dG
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.9±0.1 g/cm3
    Boiling Point: 655.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 101.4±3.0 kJ/mol
    Flash Point: 350.2±34.3 °C
    Index of Refraction: 1.808
    Molar Refractivity: 65.3±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 4
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.44
    ACD/LogD (pH 5.5): -0.01
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 21.47
    ACD/LogD (pH 7.4): 0.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 26.13
    Polar Surface Area: 106 Å2
    Polarizability: 25.9±0.5 10-24cm3
    Surface Tension: 81.1±7.0 dyne/cm
    Molar Volume: 151.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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