ChemSpider 2D Image | (8Z)-7-Methyl-11-methylene-4-(4-methyl-3-pentenoyl)-1,4a,5,6,7,10,11,11a-octahydrocyclonona[c]pyran-1,7-diyl diacetate | C24H32O6

(8Z)-7-Methyl-11-methylene-4-(4-methyl-3-pentenoyl)-1,4a,5,6,7,10,11,11a-octahydrocyclonona[c]pyran-1,7-diyl diacetate

  • Molecular FormulaC24H32O6
  • Average mass416.507 Da
  • Monoisotopic mass416.219879 Da
  • ChemSpider ID57641811

  • Double-bond stereo - Double-bond stereo

More details:

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

(8Z)-7-Methyl-11-methylen-4-(4-methyl-3-pentenoyl)-1,4a,5,6,7,10,11,11a-octahydrocyclonona[c]pyran-1,7-diyl-diacetat [German] [ACD/IUPAC Name]
(8Z)-7-Methyl-11-methylene-4-(4-methyl-3-pentenoyl)-1,4a,5,6,7,10,11,11a-octahydrocyclonona[c]pyran-1,7-diyl diacetate [ACD/IUPAC Name]
3-Penten-1-one, 1-[(8Z)-1,7-bis(acetyloxy)-1,4a,5,6,7,10,11,11a-octahydro-7-methyl-11-methylenecyclonona[c]pyran-4-yl]-4-methyl- [ACD/Index Name]
Diacétate de (8Z)-7-méthyl-11-méthylène-4-(4-méthyl-3-pentenoyl)-1,4a,5,6,7,10,11,11a-octahydrocyclonona[c]pyrane-1,7-diyle [French] [ACD/IUPAC Name]
168075-14-7 [RN]
tsitsixenicin D

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

Density: 1.1±0.1 g/cm3
Boiling Point: 506.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 216.0±30.2 °C
Index of Refraction: 1.524
Molar Refractivity: 113.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1755.36
ACD/KOC (pH 5.5): 7309.95
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1755.36
ACD/KOC (pH 7.4): 7309.95
Polar Surface Area: 79 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 41.4±5.0 dyne/cm
Molar Volume: 370.6±5.0 cm3

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