ChemSpider 2D Image | Celivarone | C34H47NO4

Celivarone

  • Molecular FormulaC34H47NO4
  • Average mass533.741 Da
  • Monoisotopic mass533.350525 Da
  • ChemSpider ID7982887

More details:






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

2-Butyl-3-{4-[3-(dibutylamino)propyl]benzoyl}-1-benzofurane-5-carboxylate d'isopropyle [French] [ACD/IUPAC Name]
5-Benzofurancarboxylic acid, 2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]-, 1-methylethyl ester [ACD/Index Name]
Celivarone [Wiki]
Isopropyl 2-butyl-3-{4-[3-(dibutylamino)propyl]benzoyl}-1-benzofuran-5-carboxylate [ACD/IUPAC Name]
Isopropyl-2-butyl-3-{4-[3-(dibutylamino)propyl]benzoyl}-1-benzofuran-5-carboxylat [German] [ACD/IUPAC Name]
2-butyl-3-[[4-[3-(dibutylamino)propyl]phenyl]-oxomethyl]-5-benzofurancarboxylic acid isopropyl ester
2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]benzofuran-5-carboxylic acid isopropyl ester
401925-43-7 [RN]
isopropyl 2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]benzofuran-5-carboxylate
propan-2-yl 2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]-1-benzofuran-5-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 637.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 339.2±31.5 °C
Index of Refraction: 1.544
Molar Refractivity: 161.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 10.24
ACD/LogD (pH 5.5): 5.29
ACD/BCF (pH 5.5): 1127.36
ACD/KOC (pH 5.5): 715.70
ACD/LogD (pH 7.4): 6.12
ACD/BCF (pH 7.4): 7654.79
ACD/KOC (pH 7.4): 4859.59
Polar Surface Area: 60 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 510.2±3.0 cm3

Click to predict properties on the Chemicalize site





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