ChemSpider 2D Image | 6-Chloro-N~4~-pentyl-2,4,5-pyrimidinetriamine | C9H16ClN5

6-Chloro-N4-pentyl-2,4,5-pyrimidinetriamine

  • Molecular FormulaC9H16ClN5
  • Average mass229.710 Da
  • Monoisotopic mass229.109421 Da
  • ChemSpider ID57255982

More details:






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

2,4,5-Pyrimidinetriamine, 6-chloro-N4-pentyl- [ACD/Index Name]
6-Chlor-N4-pentyl-2,4,5-pyrimidintriamin [German] [ACD/IUPAC Name]
6-Chloro-N4-pentyl-2,4,5-pyrimidinetriamine [ACD/IUPAC Name]
6-Chloro-N4-pentyl-2,4,5-pyrimidinetriamine [French] [ACD/IUPAC Name]
6-chloro-N4-pentylpyrimidine-2,4,5-triamine
MFCD30011899

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

Density: 1.3±0.1 g/cm3
Boiling Point: 453.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 228.1±31.5 °C
Index of Refraction: 1.638
Molar Refractivity: 63.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 190.90
ACD/KOC (pH 5.5): 1463.67
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 204.74
ACD/KOC (pH 7.4): 1569.85
Polar Surface Area: 90 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 63.0±3.0 dyne/cm
Molar Volume: 177.9±3.0 cm3

Click to predict properties on the Chemicalize site






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