ChemSpider 2D Image | (4R,7E,9E,15Z)-17-Hydroxy-7,9,15-heptadecatriene-11,13-diyn-4-yl acetate | C19H24O3

(4R,7E,9E,15Z)-17-Hydroxy-7,9,15-heptadecatriene-11,13-diyn-4-yl acetate

  • Molecular FormulaC19H24O3
  • Average mass300.392 Da
  • Monoisotopic mass300.172546 Da
  • ChemSpider ID24666242
  • 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

(4R,7E,9E,15Z)-17-Hydroxy-7,9,15-heptadecatrien-11,13-diin-4-yl-acetat [German] [ACD/IUPAC Name]
(4R,7E,9E,15Z)-17-Hydroxy-7,9,15-heptadecatriene-11,13-diyn-4-yl acetate [ACD/IUPAC Name]
2,8,10-Heptadecatriene-4,6-diyne-1,14-diol, 14-acetate, (2Z,8E,10E,14R)- [ACD/Index Name]
Acétate de (4R,7E,9E,15Z)-17-hydroxy-7,9,15-heptadécatriène-11,13-diyn-4-yle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 451.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 82.0±6.0 kJ/mol
Flash Point: 180.0±21.5 °C
Index of Refraction: 1.527
Molar Refractivity: 89.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.76
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2116.92
ACD/KOC (pH 5.5): 8358.64
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 2116.92
ACD/KOC (pH 7.4): 8358.63
Polar Surface Area: 47 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 291.0±3.0 cm3

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