ChemSpider 2D Image | Adamantan-1-yl 1-pentyl-1H-indazole-3-carboxylate | C23H30N2O2

Adamantan-1-yl 1-pentyl-1H-indazole-3-carboxylate

  • Molecular FormulaC23H30N2O2
  • Average mass366.496 Da
  • Monoisotopic mass366.230713 Da
  • ChemSpider ID59718662

More details:






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

1H-Indazole-3-carboxylic acid, 1-pentyl-, tricyclo[3.3.1.13,7]dec-1-yl ester [ACD/Index Name]
1-Pentyl-1H-indazole-3-carboxylate d'adamantan-1-yle [French] [ACD/IUPAC Name]
Adamantan-1-yl 1-pentyl-1H-indazole-3-carboxylate [ACD/IUPAC Name]
Adamantan-1-yl-1-pentyl-1H-indazol-3-carboxylat [German] [ACD/IUPAC Name]
1-adamantanyl-1-pentyl-1H-indazol-3-carboxylate
AKB-57

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

Density: 1.3±0.1 g/cm3
Boiling Point: 497.2±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.5±3.0 kJ/mol
Flash Point: 254.5±21.2 °C
Index of Refraction: 1.665
Molar Refractivity: 105.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.72
ACD/LogD (pH 5.5): 6.71
ACD/BCF (pH 5.5): 74096.99
ACD/KOC (pH 5.5): 106508.38
ACD/LogD (pH 7.4): 6.71
ACD/BCF (pH 7.4): 74096.99
ACD/KOC (pH 7.4): 106508.38
Polar Surface Area: 44 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 283.9±7.0 cm3

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