ChemSpider 2D Image | 7-Chloro-1H-pyrazolo[4,3-d]pyrimidine | C5H3ClN4

7-Chloro-1H-pyrazolo[4,3-d]pyrimidine

  • Molecular FormulaC5H3ClN4
  • Average mass154.557 Da
  • Monoisotopic mass154.004623 Da
  • ChemSpider ID28189498

More details:

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

1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro- [ACD/Index Name]
7-Chlor-1H-pyrazolo[4,3-d]pyrimidin [German] [ACD/IUPAC Name]
7-Chloro-1H-pyrazolo[4,3-d]pyrimidine [ACD/IUPAC Name]
7-Chloro-1H-pyrazolo[4,3-d]pyrimidine [French] [ACD/IUPAC Name]
923282-64-8 [RN]
??7-chloro-1h-pyrazolo[4,3-d]pyrimidine
[923282-64-8] [RN]
2-(Aminooxy)ethanol [ACD/IUPAC Name]
7-Chloro-1H-pyrazolo[4??????3-d]pyrimidine
7-Chloro-1H-pyrazolo[4??3-d]pyrimidine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 348.3±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.9±3.0 kJ/mol
    Flash Point: 195.3±7.9 °C
    Index of Refraction: 1.740
    Molar Refractivity: 37.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.05
    ACD/LogD (pH 5.5): 0.15
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 23.91
    ACD/LogD (pH 7.4): -1.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.23
    Polar Surface Area: 54 Å2
    Polarizability: 14.9±0.5 10-24cm3
    Surface Tension: 91.3±3.0 dyne/cm
    Molar Volume: 93.5±3.0 cm3

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