ChemSpider 2D Image | N~4~-(3-Chloro-4-fluorophenyl)-9H-indeno[2,1-d]pyrimidine-2,4-diamine | C17H12ClFN4

N4-(3-Chloro-4-fluorophenyl)-9H-indeno[2,1-d]pyrimidine-2,4-diamine

  • Molecular FormulaC17H12ClFN4
  • Average mass326.755 Da
  • Monoisotopic mass326.073456 Da
  • ChemSpider ID28510173

More details:

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

9H-Indeno[2,1-d]pyrimidine-2,4-diamine, N4-(3-chloro-4-fluorophenyl)- [ACD/Index Name]
N4-(3-Chlor-4-fluorphenyl)-9H-indeno[2,1-d]pyrimidin-2,4-diamin [German] [ACD/IUPAC Name]
N4-(3-Chloro-4-fluorophenyl)-9H-indeno[2,1-d]pyrimidine-2,4-diamine [ACD/IUPAC Name]
N4-(3-Chloro-4-fluorophényl)-9H-indéno[2,1-d]pyrimidine-2,4-diamine [French] [ACD/IUPAC 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: 576.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 302.6±32.9 °C
Index of Refraction: 1.741
Molar Refractivity: 88.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 97.01
ACD/KOC (pH 5.5): 374.84
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1750.08
ACD/KOC (pH 7.4): 6762.02
Polar Surface Area: 64 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 71.3±3.0 dyne/cm
Molar Volume: 219.3±3.0 cm3

Click to predict properties on the Chemicalize site


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