Found 1 result

Search term: XDZYXUUOIDIHNC (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3,15-Bis{[(E)-2-chloro-1-hydroxyvinyl]oxy}-12,13-epoxytrichothec-9-en-4-ol | C19H24Cl2O7

3,15-Bis{[(E)-2-chloro-1-hydroxyvinyl]oxy}-12,13-epoxytrichothec-9-en-4-ol

  • Molecular FormulaC19H24Cl2O7
  • Average mass435.296 Da
  • Monoisotopic mass434.089905 Da
  • ChemSpider ID95641432

More details:






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

3,15-Bis{[(E)-2-chlor-1-hydroxyvinyl]oxy}-12,13-epoxytrichothec-9-en-4-ol [German] [ACD/IUPAC Name]
3,15-Bis{[(E)-2-chloro-1-hydroxyvinyl]oxy}-12,13-epoxytrichothec-9-en-4-ol [ACD/IUPAC Name]
3,15-Bis{[(E)-2-chloro-1-hydroxyvinyl]oxy}-12,13-époxytrichothec-9-én-4-ol [French] [ACD/IUPAC Name]
Trichothec-9-en-4-ol, 3,15-bis[[(E)-2-chloro-1-hydroxyethenyl]oxy]-12,13-epoxy- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 629.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 106.8±6.0 kJ/mol
Flash Point: 334.8±31.5 °C
Index of Refraction: 1.626
Molar Refractivity: 102.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 13.62
ACD/KOC (pH 5.5): 225.50
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 11.77
ACD/KOC (pH 7.4): 194.88
Polar Surface Area: 101 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 64.0±5.0 dyne/cm
Molar Volume: 288.4±5.0 cm3

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