ChemSpider 2D Image | 5-Iodo-N,6-dimethyl-2-(2-methyl-5-nitrophenyl)-4-pyrimidinamine | C13H13IN4O2

5-Iodo-N,6-dimethyl-2-(2-methyl-5-nitrophenyl)-4-pyrimidinamine

  • Molecular FormulaC13H13IN4O2
  • Average mass384.172 Da
  • Monoisotopic mass384.008301 Da
  • ChemSpider ID49361470

More details:

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

4-Pyrimidinamine, 5-iodo-N,6-dimethyl-2-(2-methyl-5-nitrophenyl)- [ACD/Index Name]
5-Iod-N,6-dimethyl-2-(2-methyl-5-nitrophenyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
5-Iodo-N,6-dimethyl-2-(2-methyl-5-nitrophenyl)-4-pyrimidinamine [ACD/IUPAC Name]
5-Iodo-N,6-diméthyl-2-(2-méthyl-5-nitrophényl)-4-pyrimidinamine [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 407.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 200.0±28.7 °C
Index of Refraction: 1.679
Molar Refractivity: 85.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.47
ACD/LogD (pH 5.5): 3.86
ACD/BCF (pH 5.5): 499.56
ACD/KOC (pH 5.5): 2961.58
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 506.52
ACD/KOC (pH 7.4): 3002.82
Polar Surface Area: 84 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 227.1±3.0 cm3

Click to predict properties on the Chemicalize site


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