ChemSpider 2D Image | 6-Chloro-N~4~-methyl-N~4~-(4-methylphenyl)-2,4-pyrimidinediamine | C12H13ClN4

6-Chloro-N4-methyl-N4-(4-methylphenyl)-2,4-pyrimidinediamine

  • Molecular FormulaC12H13ClN4
  • Average mass248.711 Da
  • Monoisotopic mass248.082870 Da
  • ChemSpider ID24726239

More details:

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

2,4-Pyrimidinediamine, 6-chloro-N4-methyl-N4-(4-methylphenyl)- [ACD/Index Name]
6-Chlor-N4-methyl-N4-(4-methylphenyl)-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]
6-Chloro-N4-methyl-N4-(4-methylphenyl)-2,4-pyrimidinediamine [ACD/IUPAC Name]
6-Chloro-N4-méthyl-N4-(4-méthylphényl)-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 481.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 245.1±31.5 °C
Index of Refraction: 1.660
Molar Refractivity: 70.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 174.41
ACD/KOC (pH 5.5): 1392.89
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 177.52
ACD/KOC (pH 7.4): 1417.70
Polar Surface Area: 55 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 191.0±3.0 cm3

Click to predict properties on the Chemicalize site


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