ChemSpider 2D Image | (2E,4E,9Z)-2,4,9-Octadecatrien-6-yne-1,18-diyl diacetate | C22H32O4

(2E,4E,9Z)-2,4,9-Octadecatrien-6-yne-1,18-diyl diacetate

  • Molecular FormulaC22H32O4
  • Average mass360.487 Da
  • Monoisotopic mass360.230072 Da
  • ChemSpider ID24667844

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E,9Z)-2,4,9-Octadecatrien-6-in-1,18-diyl-diacetat [German] [ACD/IUPAC Name]
(2E,4E,9Z)-2,4,9-Octadecatrien-6-yne-1,18-diyl diacetate [ACD/IUPAC Name]
2,4,9-Octadecatrien-6-yne-1,18-diol, diacetate, (2E,4E,9Z)- [ACD/Index Name]
Diacétate de (2E,4E,9Z)-2,4,9-octadécatrién-6-yne-1,18-diyle [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: 473.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 228.7±27.1 °C
Index of Refraction: 1.494
Molar Refractivity: 105.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 6.00
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20449.75
ACD/KOC (pH 5.5): 42381.54
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 20449.75
ACD/KOC (pH 7.4): 42381.54
Polar Surface Area: 53 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 362.8±3.0 cm3

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