ChemSpider 2D Image | N,N,N',N'-Tetrabenzyl-5-nitro-4,6-pyrimidinediamine | C32H29N5O2

N,N,N',N'-Tetrabenzyl-5-nitro-4,6-pyrimidinediamine

  • Molecular FormulaC32H29N5O2
  • Average mass515.605 Da
  • Monoisotopic mass515.232117 Da
  • ChemSpider ID2558666

More details:

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

4,6-Pyrimidinediamine, 5-nitro-N4,N4,N6,N6-tetrakis(phenylmethyl)- [ACD/Index Name]
N,N,N',N'-Tetrabenzyl-5-nitro-4,6-pyrimidindiamin [German] [ACD/IUPAC Name]
N,N,N',N'-Tetrabenzyl-5-nitro-4,6-pyrimidinediamine [ACD/IUPAC Name]
N,N,N',N'-Tétrabenzyl-5-nitro-4,6-pyrimidinediamine [French] [ACD/IUPAC Name]
N,N,N',N'-tetrabenzyl-5-nitropyrimidine-4,6-diamine
352549-19-0 [RN]
4,6-bis(dibenzylamino)-5-nitropyrimidine
4-N,4-N,6-N,6-N-tetrabenzyl-5-nitropyrimidine-4,6-diamine
AC1MNW6R
AGN-PC-0KS7VQ
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AH-262/15227004 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 727.9±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 106.3±3.0 kJ/mol
    Flash Point: 394.0±32.9 °C
    Index of Refraction: 1.691
    Molar Refractivity: 155.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 9.35
    ACD/LogD (pH 5.5): 7.95
    ACD/BCF (pH 5.5): 650080.00
    ACD/KOC (pH 5.5): 503872.97
    ACD/LogD (pH 7.4): 7.95
    ACD/BCF (pH 7.4): 650968.56
    ACD/KOC (pH 7.4): 504561.66
    Polar Surface Area: 78 Å2
    Polarizability: 61.7±0.5 10-24cm3
    Surface Tension: 62.7±3.0 dyne/cm
    Molar Volume: 406.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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