ChemSpider 2D Image | (4E)-7,10-Dihydroxy-2-{(2E,4E)-7-[3-(3-hydroxy-2-pentanyl)-2-oxiranyl]-6-methyl-2,4-heptadien-2-yl}-3,7-dimethyl-12-oxooxacyclododec-4-ene-6,8-diyl diacetate | C32H50O10

(4E)-7,10-Dihydroxy-2-{(2E,4E)-7-[3-(3-hydroxy-2-pentanyl)-2-oxiranyl]-6-methyl-2,4-heptadien-2-yl}-3,7-dimethyl-12-oxooxacyclododec-4-ene-6,8-diyl diacetate

  • Molecular FormulaC32H50O10
  • Average mass594.733 Da
  • Monoisotopic mass594.340393 Da
  • ChemSpider ID9928352

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-7,10-Dihydroxy-2-{(2E,4E)-7-[3-(3-hydroxy-2-pentanyl)-2-oxiranyl]-6-methyl-2,4-heptadien-2-yl}-3,7-dimethyl-12-oxooxacyclododec-4-en-6,8-diyl-diacetat [German] [ACD/IUPAC Name]
(4E)-7,10-Dihydroxy-2-{(2E,4E)-7-[3-(3-hydroxy-2-pentanyl)-2-oxiranyl]-6-methyl-2,4-heptadien-2-yl}-3,7-dimethyl-12-oxooxacyclododec-4-ene-6,8-diyl diacetate [ACD/IUPAC Name]
Diacétate de (4E)-7,10-dihydroxy-2-{(2E,4E)-7-[3-(3-hydroxy-2-pentanyl)-2-oxiranyl]-6-méthyl-2,4-heptadién-2-yl}-3,7-diméthyl-12-oxooxacyclododéc-4-ène-6,8-diyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 724.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 120.8±6.0 kJ/mol
Flash Point: 222.2±26.4 °C
Index of Refraction: 1.534
Molar Refractivity: 157.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 324.35
ACD/KOC (pH 5.5): 2182.68
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 324.35
ACD/KOC (pH 7.4): 2182.67
Polar Surface Area: 152 Å2
Polarizability: 62.4±0.5 10-24cm3
Surface Tension: 48.5±5.0 dyne/cm
Molar Volume: 506.2±5.0 cm3

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