ChemSpider 2D Image | 2,5-Bis{(Z)-[3,4-diethyl-5-(2-methyl-2-propanyl)-2H-pyrrol-2-ylidene]methyl}-3,4-diethyl-1H-pyrrole | C34H51N3

2,5-Bis{(Z)-[3,4-diethyl-5-(2-methyl-2-propanyl)-2H-pyrrol-2-ylidene]methyl}-3,4-diethyl-1H-pyrrole

  • Molecular FormulaC34H51N3
  • Average mass501.789 Da
  • Monoisotopic mass501.408295 Da
  • ChemSpider ID21198122

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrrole, 2,5-bis[(Z)-[5-(1,1-dimethylethyl)-3,4-diethyl-2H-pyrrol-2-ylidene]methyl]-3,4-diethyl- [ACD/Index Name]
2,5-Bis{(Z)-[3,4-diethyl-5-(2-methyl-2-propanyl)-2H-pyrrol-2-yliden]methyl}-3,4-diethyl-1H-pyrrol [German] [ACD/IUPAC Name]
2,5-Bis{(Z)-[3,4-diethyl-5-(2-methyl-2-propanyl)-2H-pyrrol-2-ylidene]methyl}-3,4-diethyl-1H-pyrrole [ACD/IUPAC Name]
2,5-Bis{(Z)-[3,4-diéthyl-5-(2-méthyl-2-propanyl)-2H-pyrrol-2-ylidène]méthyl}-3,4-diéthyl-1H-pyrrole [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 603.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 318.8±31.5 °C
Index of Refraction: 1.541
Molar Refractivity: 159.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 9.25
ACD/LogD (pH 5.5): 5.66
ACD/BCF (pH 5.5): 2257.13
ACD/KOC (pH 5.5): 1245.76
ACD/LogD (pH 7.4): 6.84
ACD/BCF (pH 7.4): 34621.79
ACD/KOC (pH 7.4): 19108.54
Polar Surface Area: 41 Å2
Polarizability: 63.3±0.5 10-24cm3
Surface Tension: 31.3±7.0 dyne/cm
Molar Volume: 508.1±7.0 cm3

Click to predict properties on the Chemicalize site


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