ChemSpider 2D Image | Ethyl (2E,4E)-5-{11-[(E)-2-(4-ethoxy-2-methoxy-2H-oxet-2-yl)vinyl]tricyclo[8.2.2.2~4,7~]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl}-3-methoxy-2,4-pentadienoate | C32H36O6

Ethyl (2E,4E)-5-{11-[(E)-2-(4-ethoxy-2-methoxy-2H-oxet-2-yl)vinyl]tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl}-3-methoxy-2,4-pentadienoate

  • Molecular FormulaC32H36O6
  • Average mass516.625 Da
  • Monoisotopic mass516.251160 Da
  • ChemSpider ID9664030

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E)-5-{11-[(E)-2-(4-Éthoxy-2-méthoxy-2H-oxét-2-yl)vinyl]tricyclo[8.2.2.24,7]hexadéca-1(12),4,6,10,13,15-hexaén-5-yl}-3-méthoxy-2,4-pentadiénoate d'éthyle [French] [ACD/IUPAC Name]
2,4-Pentadienoic acid, 5-[11-[(E)-2-(4-ethoxy-2-methoxy-2H-oxet-2-yl)ethenyl]tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaen-5-yl]-3-methoxy-, ethyl ester, (2E,4E)- [ACD/Index Name]
Ethyl (2E,4E)-5-{11-[(E)-2-(4-ethoxy-2-methoxy-2H-oxet-2-yl)vinyl]tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl}-3-methoxy-2,4-pentadienoate [ACD/IUPAC Name]
Ethyl-(2E,4E)-5-{11-[(E)-2-(4-ethoxy-2-methoxy-2H-oxet-2-yl)vinyl]tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl}-3-methoxy-2,4-pentadienoat [German] [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: 701.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 293.6±32.9 °C
Index of Refraction: 1.594
Molar Refractivity: 148.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.04
ACD/LogD (pH 5.5): 5.93
ACD/BCF (pH 5.5): 18977.80
ACD/KOC (pH 5.5): 40174.90
ACD/LogD (pH 7.4): 5.93
ACD/BCF (pH 7.4): 18977.80
ACD/KOC (pH 7.4): 40174.90
Polar Surface Area: 63 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 49.9±5.0 dyne/cm
Molar Volume: 435.9±5.0 cm3

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