ChemSpider 2D Image | {2-[(2S)-2-Methylbutoxy]-1,6-naphthalenediyl}bis[(E)-2,1-ethenediyl-4,1-phenylene] diacetate | C35H34O5

{2-[(2S)-2-Methylbutoxy]-1,6-naphthalenediyl}bis[(E)-2,1-ethenediyl-4,1-phenylene] diacetate

  • Molecular FormulaC35H34O5
  • Average mass534.641 Da
  • Monoisotopic mass534.240601 Da
  • ChemSpider ID8681886

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

{2-[(2S)-2-Methylbutoxy]-1,6-naphthalenediyl}bis[(E)-2,1-ethenediyl-4,1-phenylene] diacetate [ACD/IUPAC Name]
{2-[(2S)-2-Methylbutoxy]-1,6-naphthalindiyl}bis[(E)-2,1-ethendiyl-4,1-phenylen]-diacetat [German] [ACD/IUPAC Name]
Diacétate de {2-[(2S)-2-méthylbutoxy]-1,6-naphtalènediyl}bis[(E)-2,1-éthènediyl-4,1-phénylène] [French] [ACD/IUPAC Name]
Phenol, 4,4'-[[2-[(2S)-2-methylbutoxy]-1,6-naphthalenediyl]di(E)-2,1-ethenediyl]bis-, diacetate [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 681.8±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 283.8±22.9 °C
Index of Refraction: 1.653
Molar Refractivity: 166.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 9.50
ACD/LogD (pH 5.5): 8.67
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1245588.50
ACD/LogD (pH 7.4): 8.67
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1245588.50
Polar Surface Area: 62 Å2
Polarizability: 66.1±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 455.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement