Found 28 results

Search term: MF = 'C_{39}H_{52}O_{7}'
ChemSpider 2D Image | 3-Hydroxy-4-[(3E,5E,7E,9E,11Z)-11-{4-[(E)-2-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)vinyl]-5-oxodihydro-3(2H)-furanylidene}-3,10-dimethyl-1,3,5,7,9-undecapentaen-1-ylidene]-3,5,5-trime thylcyclohexyl acetate | C39H52O7

3-Hydroxy-4-[(3E,5E,7E,9E,11Z)-11-{4-[(E)-2-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)vinyl]-5-oxodihydro-3(2H)-furanylidene}-3,10-dimethyl-1,3,5,7,9-undecapentaen-1-ylidene]-3,5,5-trime thylcyclohexyl acetate

  • Molecular FormulaC39H52O7
  • Average mass632.826 Da
  • Monoisotopic mass632.371277 Da
  • ChemSpider ID7985209

  • Double-bond stereo - Double-bond stereo

More details:

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

2(3H)-Furanone, 4-[(2E,4E,6E,8E)-11-[4-(acetyloxy)-2-hydroxy-2,6,6-trimethylcyclohexylidene]-2,9-dimethyl-2,4,6,8,10-undecapentaen-1-ylidene]dihydro-3-[(E)-2-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4. 1.0]hept-1-yl)ethenyl]-, (4Z)- [ACD/Index Name]
3-Hydroxy-4-[(3E,5E,7E,9E,11Z)-11-{4-[(E)-2-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)vinyl]-5-oxodihydro-3(2H)-furanyliden}-3,10-dimethyl-1,3,5,7,9-undecapentaen-1-yliden]-3,5,5-trimeth ylcyclohexyl-acetat [German] [ACD/IUPAC Name]
3-Hydroxy-4-[(3E,5E,7E,9E,11Z)-11-{4-[(E)-2-(4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)vinyl]-5-oxodihydro-3(2H)-furanylidene}-3,10-dimethyl-1,3,5,7,9-undecapentaen-1-ylidene]-3,5,5-trime thylcyclohexyl acetate [ACD/IUPAC Name]
Acétate de 3-hydroxy-4-[(3E,5E,7E,9E,11Z)-11-{4-[(E)-2-(4-hydroxy-2,2,6-triméthyl-7-oxabicyclo[4.1.0]hept-1-yl)vinyl]-5-oxodihydro-3(2H)-furanylidène}-3,10-diméthyl-1,3,5,7,9-undécapentaén-1-ylidène]- 3,5,5-triméthylcyclohexyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 752.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 125.2±6.0 kJ/mol
Flash Point: 225.8±26.4 °C
Index of Refraction: 1.573
Molar Refractivity: 181.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 5.73
ACD/BCF (pH 5.5): 13283.82
ACD/KOC (pH 5.5): 31121.64
ACD/LogD (pH 7.4): 5.73
ACD/BCF (pH 7.4): 13283.82
ACD/KOC (pH 7.4): 31121.64
Polar Surface Area: 106 Å2
Polarizability: 71.9±0.5 10-24cm3
Surface Tension: 43.5±5.0 dyne/cm
Molar Volume: 551.0±5.0 cm3

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