ChemSpider 2D Image | 2-Methyl-5-[(14E)-14-nonadecen-1-yl]-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl diacetate | C30H46O6

2-Methyl-5-[(14E)-14-nonadecen-1-yl]-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl diacetate

  • Molecular FormulaC30H46O6
  • Average mass502.683 Da
  • Monoisotopic mass502.329437 Da
  • ChemSpider ID4905623

  • Double-bond stereo - Double-bond stereo

More details:

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

2,5-Cyclohexadiene-1,4-dione, 2,5-bis(acetyloxy)-3-methyl-6-[(14E)-14-nonadecen-1-yl]- [ACD/Index Name]
2-Methyl-5-[(14E)-14-nonadecen-1-yl]-3,6-dioxo-1,4-cyclohexadien-1,4-diyl-diacetat [German] [ACD/IUPAC Name]
2-Methyl-5-[(14E)-14-nonadecen-1-yl]-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl diacetate [ACD/IUPAC Name]
2-Methyl-5-[(14E)-nonadec-14-en-1-yl]-3,6-dioxocyclohexa-1,4-diene-1,4-diyl diacetate
Diacétate de 2-méthyl-5-[(14E)-14-nonadécén-1-yl]-3,6-dioxo-1,4-cyclohexadiène-1,4-diyle [French] [ACD/IUPAC Name]
2654-75-3 [RN]
Acetic acid 4-acetoxy-2-methyl-5-((E)-nonadec-14-e
Acetic acid 4-acetoxy-2-methyl-5-((E)-nonadec-14-enyl)-3,6-dioxo-cyclohexa-1,4-dienyl ester
Acetic acid-4-acetoxy-2-methyl-5-((E)-nonadec-14-
Acetic acid-4-acetoxy-2-methyl-5-((E)-nonadec-14-enyl)-3,6-dioxo-cyclohexa-1,4-dienyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 589.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 244.4±30.2 °C
Index of Refraction: 1.503
Molar Refractivity: 141.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 10.95
ACD/LogD (pH 5.5): 9.05
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1991203.50
ACD/LogD (pH 7.4): 9.05
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1991203.50
Polar Surface Area: 87 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 40.9±5.0 dyne/cm
Molar Volume: 479.2±5.0 cm3

Click to predict properties on the Chemicalize site


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