ChemSpider 2D Image | 5-Chloro-4-{3-[(dimethylamino)methyl]-1-pyrrolidinyl}-6-methyl-2-pyrimidinamine | C12H20ClN5

5-Chloro-4-{3-[(dimethylamino)methyl]-1-pyrrolidinyl}-6-methyl-2-pyrimidinamine

  • Molecular FormulaC12H20ClN5
  • Average mass269.774 Da
  • Monoisotopic mass269.140717 Da
  • ChemSpider ID67900164

More details:

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

2-Pyrimidinamine, 5-chloro-4-[3-[(dimethylamino)methyl]-1-pyrrolidinyl]-6-methyl- [ACD/Index Name]
5-Chlor-4-{3-[(dimethylamino)methyl]-1-pyrrolidinyl}-6-methyl-2-pyrimidinamin [German] [ACD/IUPAC Name]
5-Chloro-4-{3-[(dimethylamino)methyl]-1-pyrrolidinyl}-6-methyl-2-pyrimidinamine [ACD/IUPAC Name]
5-Chloro-4-{3-[(diméthylamino)méthyl]-1-pyrrolidinyl}-6-méthyl-2-pyrimidinamine [French] [ACD/IUPAC Name]
5-chloro-4-{3-[(dimethylamino)methyl]pyrrolidin-1-yl}-6-methylpyrimidin-2-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 457.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 230.5±31.5 °C
Index of Refraction: 1.583
Molar Refractivity: 74.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.30
Polar Surface Area: 58 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 222.2±3.0 cm3

Click to predict properties on the Chemicalize site


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