ChemSpider 2D Image | 5-[(Z)-[(5E)-5-[[5-[(Z)-(3,4-diethyl-5-oxo-pyrrol-2-ylidene)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methylene]-3,4-diethyl-pyrrol-2-ylidene]methyl]-3,4-diethyl-pyrrol-2-one | C35H46N4O2

5-[(Z)-[(5E)-5-[[5-[(Z)-(3,4-diethyl-5-oxo-pyrrol-2-ylidene)methyl]-3,4-diethyl-1H-pyrrol-2-yl]methylene]-3,4-diethyl-pyrrol-2-ylidene]methyl]-3,4-diethyl-pyrrol-2-one

  • Molecular FormulaC35H46N4O2
  • Average mass554.765 Da
  • Monoisotopic mass554.362061 Da
  • ChemSpider ID4947339
  • Double-bond stereo - Double-bond stereo


More details:






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

21H-Biline-1,19-dione, 2,3,7,8,12,13,17,18-octaethyl-22,24-dihydro-
35050-46-5 [RN]
Octaethylbiliverdin

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.597
Molar Refractivity: 166.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 6.54
ACD/BCF (pH 5.5): 55282.48
ACD/KOC (pH 5.5): 86160.17
ACD/LogD (pH 7.4): 6.55
ACD/BCF (pH 7.4): 55734.83
ACD/KOC (pH 7.4): 86865.16
Polar Surface Area: 86 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 38.8±7.0 dyne/cm
Molar Volume: 487.5±7.0 cm3

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