ChemSpider 2D Image | 12'-Hydroxy-5',13',25'-trimethyl-6'H,11'H,17'H,22'H-spiro[oxirane-2,26'-[2,10,16,23]tetraoxatetracyclo[22.2.1.0~3,8~.0~8,25~]heptacosa[4,18,20]triene]-6',11',17',22'-tetrone | C27H32O10

12'-Hydroxy-5',13',25'-trimethyl-6'H,11'H,17'H,22'H-spiro[oxirane-2,26'-[2,10,16,23]tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa[4,18,20]triene]-6',11',17',22'-tetrone

  • Molecular FormulaC27H32O10
  • Average mass516.537 Da
  • Monoisotopic mass516.199524 Da
  • ChemSpider ID381812

More details:

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

12'-Hydroxy-5',13',25'-trimethyl-6'H,11'H,17'H,22'H-spiro[oxirane-2,26'-[2,10,16,23]tetraoxatetracyclo[22.2.1.03,8.08,25]heptacosa[4,18,20]triene]-6',11',17',22'-tetrone [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 796.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.9±6.0 kJ/mol
Flash Point: 267.5±26.4 °C
Index of Refraction: 1.591
Molar Refractivity: 127.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: -0.80
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.23
ACD/KOC (pH 5.5): 40.33
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.23
ACD/KOC (pH 7.4): 40.33
Polar Surface Area: 138 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 59.1±5.0 dyne/cm
Molar Volume: 375.6±5.0 cm3

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