ChemSpider 2D Image | 5-(1,2-Dihydroxyethyl)-2,4-dioxotetrahydro-3-furanyl 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl (2E)-2-butenedioate | C37H54O10

5-(1,2-Dihydroxyethyl)-2,4-dioxotetrahydro-3-furanyl 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl (2E)-2-butenedioate

  • Molecular FormulaC37H54O10
  • Average mass658.819 Da
  • Monoisotopic mass658.371704 Da
  • ChemSpider ID8071604

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-Butènedioate de 5-(1,2-dihydroxyéthyl)-2,4-dioxotétrahydro-3-furanyle et de 2,8-diméthyl-2-(4,8,12-triméthyltridécyl)-3,4-dihydro-2H-chromén-6-yle [French] [ACD/IUPAC Name]
5-(1,2-Dihydroxyethyl)-2,4-dioxotetrahydro-3-furanyl 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl (2E)-2-butenedioate [ACD/IUPAC Name]
5-(1,2-Dihydroxyethyl)-2,4-dioxotetrahydro-3-furanyl-2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl-(2E)-2-butendioat [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: 791.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.7±3.0 kJ/mol
Flash Point: 238.1±26.4 °C
Index of Refraction: 1.546
Molar Refractivity: 176.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 8.43
ACD/LogD (pH 5.5): 6.14
ACD/BCF (pH 5.5): 27181.55
ACD/KOC (pH 5.5): 51878.14
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 19227.89
ACD/KOC (pH 7.4): 36697.96
Polar Surface Area: 146 Å2
Polarizability: 70.0±0.5 10-24cm3
Surface Tension: 50.9±5.0 dyne/cm
Molar Volume: 557.4±5.0 cm3

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