ChemSpider 2D Image | 2-[(2E)-2-Benzylidenehydrazino]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine | C17H17F3N4

2-[(2E)-2-Benzylidenehydrazino]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine

  • Molecular FormulaC17H17F3N4
  • Average mass334.339 Da
  • Monoisotopic mass334.140533 Da
  • ChemSpider ID22941282

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(2E)-2-Benzylidenehydrazino]-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine [ACD/IUPAC Name]
2-[(2E)-2-Benzylidènehydrazino]-4-(trifluorométhyl)-6,7,8,9-tétrahydro-5H-cyclohepta[d]pyrimidine [French] [ACD/IUPAC Name]
2-[(2E)-2-Benzylidenhydrazino]-4-(trifluormethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin [German] [ACD/IUPAC Name]
Benzaldehyde, 2-[6,7,8,9-tetrahydro-4-(trifluoromethyl)-5H-cyclohepta[d]pyrimidin-2-yl]hydrazone [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 449.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 225.4±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 85.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.46
ACD/BCF (pH 5.5): 1447.92
ACD/KOC (pH 5.5): 6368.67
ACD/LogD (pH 7.4): 4.46
ACD/BCF (pH 7.4): 1447.28
ACD/KOC (pH 7.4): 6365.88
Polar Surface Area: 50 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 40.8±7.0 dyne/cm
Molar Volume: 253.6±7.0 cm3

Click to predict properties on the Chemicalize site


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