ChemSpider 2D Image | 2,4,5-Trichloro-1H-pyrrolo[2,3-d]pyrimidine | C6H2Cl3N3

2,4,5-Trichloro-1H-pyrrolo[2,3-d]pyrimidine

  • Molecular FormulaC6H2Cl3N3
  • Average mass222.459 Da
  • Monoisotopic mass220.931427 Da
  • ChemSpider ID24583379

More details:

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

1053228-28-6 [RN]
2,4,5-Trichlor-1H-pyrrolo[2,3-d]pyrimidin [German] [ACD/IUPAC Name]
2,4,5-Trichloro-1H-pyrrolo[2,3-d]pyrimidine [ACD/IUPAC Name]
2,4,5-Trichloro-1H-pyrrolo[2,3-d]pyrimidine [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidine, 2,4,5-trichloro- [ACD/Index Name]
[1053228-28-6] [RN]
2,4,5-TRICHLORO-7H-PYRROLO-[2,3-D]PYRIMIDINE
2,4,5-trichloro-7h-pyrrolo[2,3-d]pyrimidine(wx130103)
2,4,5-Trichloro-7H-pyrrolo[2,3-d]pyrimidine?
BR-31644
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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: 1.8±0.1 g/cm3
    Boiling Point: 342.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.3±3.0 kJ/mol
    Flash Point: 191.3±13.5 °C
    Index of Refraction: 1.727
    Molar Refractivity: 49.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.51
    ACD/LogD (pH 5.5): 2.41
    ACD/BCF (pH 5.5): 40.32
    ACD/KOC (pH 5.5): 490.63
    ACD/LogD (pH 7.4): 2.39
    ACD/BCF (pH 7.4): 38.42
    ACD/KOC (pH 7.4): 467.49
    Polar Surface Area: 42 Å2
    Polarizability: 19.6±0.5 10-24cm3
    Surface Tension: 76.0±3.0 dyne/cm
    Molar Volume: 124.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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