ChemSpider 2D Image | (1S,3R,5R,6S,7R,8S)-6,8-Dihydroxy-11H-spiro[4,12-dioxatetracyclo[5.4.1.0~1,7~.0~3,5~]dodec-9-ene-2,2'-naphtho[1,8-de][1,3]dioxin]-11-one | C20H14O7

(1S,3R,5R,6S,7R,8S)-6,8-Dihydroxy-11H-spiro[4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene-2,2'-naphtho[1,8-de][1,3]dioxin]-11-one

  • Molecular FormulaC20H14O7
  • Average mass366.321 Da
  • Monoisotopic mass366.073944 Da
  • ChemSpider ID28469229

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1S,3R,5R,6S,7R,8S)-6,8-Dihydroxy-11H-spiro[4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene-2,2'-naphtho[1,8-de][1,3]dioxin]-11-one [ACD/IUPAC Name]
155866-40-3 [RN]
Cladospirone bisepoxide
Cladospironebisepoxide

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

Density: 1.8±0.1 g/cm3
Boiling Point: 762.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.5±3.0 kJ/mol
Flash Point: 284.9±26.4 °C
Index of Refraction: 1.828
Molar Refractivity: 90.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 302.15
ACD/KOC (pH 5.5): 2074.67
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 302.15
ACD/KOC (pH 7.4): 2074.67
Polar Surface Area: 101 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 98.0±5.0 dyne/cm
Molar Volume: 206.2±5.0 cm3

Click to predict properties on the Chemicalize site


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