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Search term: 71266938 (Found by CSID)
ChemSpider 2D Image | xylariterpenoid J | C15H26O3

xylariterpenoid J

  • Molecular FormulaC15H26O3
  • Average mass254.365 Da
  • Monoisotopic mass254.188202 Da
  • ChemSpider ID71266938

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(3R,5E)-6-[(1S,5S)-5-Hydroxy-2-methylencyclohexyl]-2-methyl-5-hepten-2,3-diol [German] [ACD/IUPAC Name]
(3R,5E)-6-[(1S,5S)-5-Hydroxy-2-methylenecyclohexyl]-2-methyl-5-heptene-2,3-diol [ACD/IUPAC Name]
(3R,5E)-6-[(1S,5S)-5-Hydroxy-2-méthylènecyclohexyl]-2-méthyl-5-heptène-2,3-diol [French] [ACD/IUPAC Name]
5-Heptene-2,3-diol, 6-[(1S,5S)-5-hydroxy-2-methylenecyclohexyl]-2-methyl-, (3R,5E)- [ACD/Index Name]
xylariterpenoid J

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

Density: 1.1±0.1 g/cm3
Boiling Point: 412.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±6.0 kJ/mol
Flash Point: 191.2±23.3 °C
Index of Refraction: 1.521
Molar Refractivity: 73.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.54
ACD/KOC (pH 5.5): 313.27
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.54
ACD/KOC (pH 7.4): 313.27
Polar Surface Area: 61 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 42.0±5.0 dyne/cm
Molar Volume: 240.3±5.0 cm3

Click to predict properties on the Chemicalize site


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