ChemSpider 2D Image | 5-Iodo-2-(2-methyl-2-propanyl)-4-pyrimidinamine | C8H12IN3

5-Iodo-2-(2-methyl-2-propanyl)-4-pyrimidinamine

  • Molecular FormulaC8H12IN3
  • Average mass277.105 Da
  • Monoisotopic mass277.007568 Da
  • ChemSpider ID48219886

More details:

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

4-Pyrimidinamine, 2-(1,1-dimethylethyl)-5-iodo- [ACD/Index Name]
5-Iod-2-(2-methyl-2-propanyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
5-Iodo-2-(2-methyl-2-propanyl)-4-pyrimidinamine [ACD/IUPAC Name]
5-Iodo-2-(2-méthyl-2-propanyl)-4-pyrimidinamine [French] [ACD/IUPAC Name]
1499077-58-5 [RN]
2-tert-butyl-5-iodopyrimidin-4-amine
MFCD21745696

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 309.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.0±3.0 kJ/mol
Flash Point: 141.1±23.7 °C
Index of Refraction: 1.611
Molar Refractivity: 58.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 56.34
ACD/KOC (pH 5.5): 605.17
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 62.50
ACD/KOC (pH 7.4): 671.32
Polar Surface Area: 52 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 166.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement