ChemSpider 2D Image | 1,4-Didodecyl-2,5-bis({4-[(4-ethynylphenyl)ethynyl]phenyl}ethynyl)benzene | C66H70

1,4-Didodecyl-2,5-bis({4-[(4-ethynylphenyl)ethynyl]phenyl}ethynyl)benzene

  • Molecular FormulaC66H70
  • Average mass863.262 Da
  • Monoisotopic mass862.547729 Da
  • ChemSpider ID29289769

More details:

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

1,4-Didodecyl-2,5-bis({4-[(4-ethinylphenyl)ethinyl]phenyl}ethinyl)benzol [German] [ACD/IUPAC Name]
1,4-Didodecyl-2,5-bis({4-[(4-ethynylphenyl)ethynyl]phenyl}ethynyl)benzene [ACD/IUPAC Name]
1,4-Didodécyl-2,5-bis({4-[(4-éthynylphényl)éthynyl]phényl}éthynyl)benzène [French] [ACD/IUPAC Name]
Benzene, 1,4-didodecyl-2,5-bis[2-[4-[2-(4-ethynylphenyl)ethynyl]phenyl]ethynyl]- [ACD/Index Name]
1,4-Didodecyl-2,5-bis(2-(4-(2-(4-ethynylphenyl)ethynyl)phenyl)ethynyl)benzene

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

Density: 1.1±0.1 g/cm3
Boiling Point: 904.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 127.1±0.8 kJ/mol
Flash Point: 519.4±28.4 °C
Index of Refraction: 1.612
Molar Refractivity: 279.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 2
ACD/LogP: 25.44
ACD/LogD (pH 5.5): 22.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 22.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 111.0±0.5 10-24cm3
Surface Tension: 55.5±5.0 dyne/cm
Molar Volume: 805.1±5.0 cm3

Click to predict properties on the Chemicalize site


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