ChemSpider 2D Image | 6-(4-Methoxyphenyl)-N~4~-octyl-2,4-pyrimidinediamine | C19H28N4O

6-(4-Methoxyphenyl)-N4-octyl-2,4-pyrimidinediamine

  • Molecular FormulaC19H28N4O
  • Average mass328.452 Da
  • Monoisotopic mass328.226318 Da
  • ChemSpider ID35033968

More details:






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

2,4-Pyrimidinediamine, 6-(4-methoxyphenyl)-N4-octyl- [ACD/Index Name]
6-(4-Methoxyphenyl)-N4-octyl-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]
6-(4-Methoxyphenyl)-N4-octyl-2,4-pyrimidinediamine [ACD/IUPAC Name]
6-(4-Méthoxyphényl)-N4-octyl-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]
6-(4-Methoxyphenyl)-N4-Octylpyrimidine-2,4-Diamine
KK1

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

Density: 1.1±0.1 g/cm3
Boiling Point: 553.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 288.4±32.9 °C
Index of Refraction: 1.575
Molar Refractivity: 100.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 6.10
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 386.02
ACD/KOC (pH 5.5): 978.09
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 7506.35
ACD/KOC (pH 7.4): 19019.48
Polar Surface Area: 73 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 302.5±3.0 cm3

Click to predict properties on the Chemicalize site






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