ChemSpider 2D Image | 2,4,7-Trichloro-5H-pyrrolo[3,2-d]pyrimidine | C6H2Cl3N3

2,4,7-Trichloro-5H-pyrrolo[3,2-d]pyrimidine

  • Molecular FormulaC6H2Cl3N3
  • Average mass222.459 Da
  • Monoisotopic mass220.931427 Da
  • ChemSpider ID30648364

More details:

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

1923177-10-9 [RN]
2,4,7-Trichlor-5H-pyrrolo[3,2-d]pyrimidin [German] [ACD/IUPAC Name]
2,4,7-Trichloro-5H-pyrrolo[3,2-d]pyrimidine [ACD/IUPAC Name]
2,4,7-Trichloro-5H-pyrrolo[3,2-d]pyrimidine [French] [ACD/IUPAC Name]
5H-Pyrrolo[3,2-d]pyrimidine, 2,4,7-trichloro- [ACD/Index Name]
T56 BM FN HNJ DG GG IG [WLN]
ClC1=CNC2=C(Cl)N=C(Cl)N=C21
MFCD22398070 [MDL number]

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

    Density: 1.8±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    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: 2.63
    ACD/LogD (pH 5.5): 2.48
    ACD/BCF (pH 5.5): 45.36
    ACD/KOC (pH 5.5): 533.85
    ACD/LogD (pH 7.4): 2.47
    ACD/BCF (pH 7.4): 44.46
    ACD/KOC (pH 7.4): 523.27
    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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