Found 1 result

Search term: 157557-36-3 (Found by synonym)
ChemSpider 2D Image | 4',4'''-Bis[4-(2-methyl-2-propanyl)phenyl]-2,2':6',2'':6'',2''':6''',2''''-quinquepyridine | C45H41N5

4',4'''-Bis[4-(2-methyl-2-propanyl)phenyl]-2,2':6',2'':6'',2''':6''',2''''-quinquepyridine

  • Molecular FormulaC45H41N5
  • Average mass651.841 Da
  • Monoisotopic mass651.336182 Da
  • ChemSpider ID35519028

More details:

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

2,2':6',2'':6'',2''':6''',2''''-Quinquepyridine, 4',4'''-bis[4-(1,1-dimethylethyl)phenyl]- [ACD/Index Name]
4',4'''-Bis[4-(2-methyl-2-propanyl)phenyl]-2,2':6',2'':6'',2''':6''',2''''-quinquepyridin [German] [ACD/IUPAC Name]
4',4'''-Bis[4-(2-methyl-2-propanyl)phenyl]-2,2':6',2'':6'',2''':6''',2''''-quinquepyridine [ACD/IUPAC Name]
4',4'''-Bis[4-(2-méthyl-2-propanyl)phényl]-2,2':6',2'':6'',2''':6''',2''''-quinquepyridine [French] [ACD/IUPAC Name]
157557-36-3 [RN]
4',4'''-Bis(4-tert-butylphenyl)-2,2':6',2'':6'',2''':6''',2''''-quinquepyridine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 734.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 290.6±24.5 °C
Index of Refraction: 1.609
Molar Refractivity: 201.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 12.07
ACD/LogD (pH 5.5): 10.07
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 7110819.50
ACD/LogD (pH 7.4): 10.07
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 7149492.50
Polar Surface Area: 64 Å2
Polarizability: 79.7±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 580.6±3.0 cm3

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