ChemSpider 2D Image | CSID:21431295 | C26H38O5

  • Molecular FormulaC26H38O5
  • Average mass430.577 Da
  • Monoisotopic mass430.271912 Da
  • ChemSpider ID21431295

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

3H-4,10b-Propano-1H-naphtho[1,2-c]pyran-3,8-diol, 7-[(2,5-dihydroxyphenyl)methyl]decahydro-4,6a,8-trimethyl-, (3R,4S,4aR,6aR,7S,8S,10aS,10bS)- [ACD/Index Name]
strongylophorine 13

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

Density: 1.3±0.1 g/cm3
Boiling Point: 615.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 326.3±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 119.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 345.67
ACD/KOC (pH 5.5): 2284.44
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 345.41
ACD/KOC (pH 7.4): 2282.70
Polar Surface Area: 90 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 339.9±5.0 cm3

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