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Search term: 81367103 (Found by CSID)
ChemSpider 2D Image | trichoderolide E | C19H18O5

trichoderolide E

  • Molecular FormulaC19H18O5
  • Average mass326.343 Da
  • Monoisotopic mass326.115417 Da
  • ChemSpider ID81367103

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,5R)-5-Benzyl-2-oxotetrahydro-3-furanyl 4-methoxybenzoate (non-preferred name) [ACD/IUPAC Name]
(3R,5R)-5-Benzyl-2-oxotetrahydro-3-furanyl-4-methoxybenzoat (non-preferred name) [German] [ACD/IUPAC Name]
4-Méthoxybenzoate de (3R,5R)-5-benzyl-2-oxotétrahydro-3-furanyle (non-preferred name) [French] [ACD/IUPAC Name]
trichoderolide E

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

Density: 1.3±0.1 g/cm3
Boiling Point: 520.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.4±3.0 kJ/mol
Flash Point: 230.8±27.4 °C
Index of Refraction: 1.588
Molar Refractivity: 87.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 124.93
ACD/KOC (pH 5.5): 1102.54
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 124.93
ACD/KOC (pH 7.4): 1102.54
Polar Surface Area: 62 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 259.1±5.0 cm3

Click to predict properties on the Chemicalize site


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