ChemSpider 2D Image | 4-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2-methyl-6-[(~2~H_3_)methyloxy]-5-pyrimidinamine | C9H9D3ClN5O

4-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2-methyl-6-[(2H3)methyloxy]-5-pyrimidinamine

  • Molecular FormulaC9H9D3ClN5O
  • Average mass244.696 Da
  • Monoisotopic mass244.091873 Da
  • ChemSpider ID82951950

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Chlor-N-(4,5-dihydro-1H-imidazol-2-yl)-2-methyl-6-[(2H3)methyloxy]-5-pyrimidinamin [German] [ACD/IUPAC Name]
4-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2-methyl-6-[(2H3)methyloxy]-5-pyrimidinamine [ACD/IUPAC Name]
4-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2-méthyl-6-[(2H3)méthyloxy]-5-pyrimidinamine [French] [ACD/IUPAC Name]
5-Pyrimidinamine, 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2-methyl-6-(methyl-d3-oxy)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 364.7±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.1±3.0 kJ/mol
Flash Point: 174.3±30.7 °C
Index of Refraction: 1.681
Molar Refractivity: 59.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.84
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.61
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 2.04
ACD/KOC (pH 7.4): 51.59
Polar Surface Area: 71 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 158.1±7.0 cm3

Click to predict properties on the Chemicalize site


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