ChemSpider 2D Image | (3S,4E,6R,15Z,29R,30E,32S)-4,15,30-Tetratriacontatriene-1,33-diyne-3,6,29,32-tetrol | C34H56O4

(3S,4E,6R,15Z,29R,30E,32S)-4,15,30-Tetratriacontatriene-1,33-diyne-3,6,29,32-tetrol

  • Molecular FormulaC34H56O4
  • Average mass528.806 Da
  • Monoisotopic mass528.417847 Da
  • ChemSpider ID44210844

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3S,4E,6R,15Z,29R,30E,32S)-4,15,30-Tetratriacontatrien-1,33-diin-3,6,29,32-tetrol [German] [ACD/IUPAC Name]
(3S,4E,6R,15Z,29R,30E,32S)-4,15,30-Tetratriacontatriene-1,33-diyne-3,6,29,32-tetrol [ACD/IUPAC Name]
(3S,4E,6R,15Z,29R,30E,32S)-4,15,30-Tétratriacontatriène-1,33-diyne-3,6,29,32-tétrol [French] [ACD/IUPAC Name]
4,15,30-Tetratriacontatriene-1,33-diyne-3,6,29,32-tetrol, (3S,4E,6R,15Z,29R,30E,32S)- [ACD/Index 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: 661.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.4±6.0 kJ/mol
Flash Point: 257.6±26.1 °C
Index of Refraction: 1.521
Molar Refractivity: 161.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 28
#Rule of 5 Violations: 2
ACD/LogP: 8.93
ACD/LogD (pH 5.5): 7.01
ACD/BCF (pH 5.5): 124047.46
ACD/KOC (pH 5.5): 154016.83
ACD/LogD (pH 7.4): 7.01
ACD/BCF (pH 7.4): 124043.92
ACD/KOC (pH 7.4): 154012.44
Polar Surface Area: 81 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 529.7±3.0 cm3

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