ChemSpider 2D Image | (6aS,11bR)-7,11b-Dihydroindeno[2,1-c]chromene-3,6a,8,9(6H)-tetrol | C16H14O5

(6aS,11bR)-7,11b-Dihydroindeno[2,1-c]chromene-3,6a,8,9(6H)-tetrol

  • Molecular FormulaC16H14O5
  • Average mass286.279 Da
  • Monoisotopic mass286.084137 Da
  • ChemSpider ID28648229
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(6aS,11bR)-7,11b-Dihydroindeno[2,1-c]chromen-3,6a,8,9(6H)-tetrol [German] [ACD/IUPAC Name]
(6aS,11bR)-7,11b-Dihydroindeno[2,1-c]chromene-3,6a,8,9(6H)-tetrol [ACD/IUPAC Name]
(6aS,11bR)-7,11b-Dihydroindéno[2,1-c]chromène-3,6a,8,9(6H)-tétrol [French] [ACD/IUPAC Name]
Benz[b]indeno[1,2-d]pyran-3,6a,8,9(6H)-tetrol, 7,11b-dihydro-, (6aS,11bR)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 538.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.9±3.0 kJ/mol
Flash Point: 279.7±30.1 °C
Index of Refraction: 1.774
Molar Refractivity: 74.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 11.60
ACD/KOC (pH 5.5): 201.21
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 11.46
ACD/KOC (pH 7.4): 198.75
Polar Surface Area: 90 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 93.8±3.0 dyne/cm
Molar Volume: 178.4±3.0 cm3

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