ChemSpider 2D Image | 3-{[4-Chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino}-1-methyl-2,6-piperidinedione | C12H17ClN6O2

3-{[4-Chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino}-1-methyl-2,6-piperidinedione

  • Molecular FormulaC12H17ClN6O2
  • Average mass312.755 Da
  • Monoisotopic mass312.110138 Da
  • ChemSpider ID36461665

More details:

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

2,6-Piperidinedione, 3-[[4-chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino]-1-methyl- [ACD/Index Name]
3-{[4-Chlor-6-(propylamino)-1,3,5-triazin-2-yl]amino}-1-methyl-2,6-piperidindion [German] [ACD/IUPAC Name]
3-{[4-Chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino}-1-methyl-2,6-piperidinedione [ACD/IUPAC Name]
3-{[4-Chloro-6-(propylamino)-1,3,5-triazin-2-yl]amino}-1-méthyl-2,6-pipéridinedione [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 555.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 289.9±32.9 °C
Index of Refraction: 1.638
Molar Refractivity: 78.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.66
ACD/KOC (pH 5.5): 314.19
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.75
ACD/KOC (pH 7.4): 315.42
Polar Surface Area: 100 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 75.9±3.0 dyne/cm
Molar Volume: 219.5±3.0 cm3

Click to predict properties on the Chemicalize site


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