ChemSpider 2D Image | N,N-Diethyl-6-iodo-4-pyrimidinamine | C8H12IN3

N,N-Diethyl-6-iodo-4-pyrimidinamine

  • Molecular FormulaC8H12IN3
  • Average mass277.105 Da
  • Monoisotopic mass277.007568 Da
  • ChemSpider ID32076310

More details:

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

1704065-04-2 [RN]
4-Pyrimidinamine, N,N-diethyl-6-iodo- [ACD/Index Name]
N,N-Diethyl-6-iod-4-pyrimidinamin [German] [ACD/IUPAC Name]
N,N-Diethyl-6-iodo-4-pyrimidinamine [ACD/IUPAC Name]
N,N-Diéthyl-6-iodo-4-pyrimidinamine [French] [ACD/IUPAC Name]
6602-54-6 [RN]
MFCD28400201
N,N-diethyl-6-iodopyrimidin-4-amine

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 335.5±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.9±3.0 kJ/mol
    Flash Point: 156.7±23.7 °C
    Index of Refraction: 1.614
    Molar Refractivity: 58.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.27
    ACD/LogD (pH 5.5): 2.68
    ACD/BCF (pH 5.5): 63.94
    ACD/KOC (pH 5.5): 681.36
    ACD/LogD (pH 7.4): 2.68
    ACD/BCF (pH 7.4): 64.36
    ACD/KOC (pH 7.4): 685.84
    Polar Surface Area: 29 Å2
    Polarizability: 23.4±0.5 10-24cm3
    Surface Tension: 51.6±3.0 dyne/cm
    Molar Volume: 169.0±3.0 cm3

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