ChemSpider 2D Image | 2-(Adamantan-1-yl)-N'-({1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-4(1H)-isoquinolinylidene}methyl)acetohydrazide | C29H28F3N3O3

2-(Adamantan-1-yl)-N'-({1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-4(1H)-isoquinolinylidene}methyl)acetohydrazide

  • Molecular FormulaC29H28F3N3O3
  • Average mass523.546 Da
  • Monoisotopic mass523.208252 Da
  • ChemSpider ID5203612

More details:

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

2-(Adamantan-1-yl)-N'-({1,3-dioxo-2-[3-(trifluormethyl)phenyl]-2,3-dihydro-4(1H)-isochinolinyliden}methyl)acetohydrazid [German] [ACD/IUPAC Name]
2-(Adamantan-1-yl)-N'-({1,3-dioxo-2-[3-(trifluorométhyl)phényl]-2,3-dihydro-4(1H)-isoquinoléinylidène}méthyl)acétohydrazide [French] [ACD/IUPAC Name]
2-(Adamantan-1-yl)-N'-({1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-4(1H)-isoquinolinylidene}methyl)acetohydrazide [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-acetic acid, 2-[[2,3-dihydro-1,3-dioxo-2-[3-(trifluoromethyl)phenyl]-4(1H)-isoquinolinylidene]methyl]hydrazide [ACD/Index Name]

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

Density: 1.4±0.0 g/cm3
Boiling Point: 633.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 93.7±0.0 kJ/mol
Flash Point: 337.0±0.0 °C
Index of Refraction: 1.633
Molar Refractivity: 134.5±0.0 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 5.99
ACD/BCF (pH 5.5): 20883.02
ACD/KOC (pH 5.5): 43022.31
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 20882.44
ACD/KOC (pH 7.4): 43021.13
Polar Surface Area: 79 Å2
Polarizability: 53.3±0.0 10-24cm3
Surface Tension: 56.6±0.0 dyne/cm
Molar Volume: 376.7±0.0 cm3

Click to predict properties on the Chemicalize site


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