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Search term: 78436051 (Found by CSID)
ChemSpider 2D Image | 10-Hydroxy-3,3,6,9,12-pentamethyl-1H,7H-2,4,8,13-tetraoxabenzo[5,6]cyclohepta[1,2-a]naphthalen-7-one | C20H20O6

10-Hydroxy-3,3,6,9,12-pentamethyl-1H,7H-2,4,8,13-tetraoxabenzo[5,6]cyclohepta[1,2-a]naphthalen-7-one

  • Molecular FormulaC20H20O6
  • Average mass356.369 Da
  • Monoisotopic mass356.125977 Da
  • ChemSpider ID78436051

More details:

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

10-Hydroxy-3,3,6,9,12-pentaméthyl-1H,7H-2,4,8,13-tétraoxabenzo[5,6]cyclohepta[1,2-a]naphtalén-7-one [French] [ACD/IUPAC Name]
10-Hydroxy-3,3,6,9,12-pentamethyl-1H,7H-2,4,8,13-tetraoxabenzo[5,6]cyclohepta[1,2-a]naphthalen-7-one [ACD/IUPAC Name]
10-Hydroxy-3,3,6,9,12-pentamethyl-1H,7H-2,4,8,13-tetraoxabenzo[5,6]cyclohepta[1,2-a]naphthalin-7-on [German] [ACD/IUPAC Name]
1H,7H-2,4,8,13-Tetraoxabenzo[5,6]cyclohepta[1,2-a]naphthalen-7-one, 10-hydroxy-3,3,6,9,12-pentamethyl- [ACD/Index Name]
Simplicildone C

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

Density: 1.3±0.1 g/cm3
Boiling Point: 563.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 203.1±23.6 °C
Index of Refraction: 1.591
Molar Refractivity: 93.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 523.26
ACD/KOC (pH 5.5): 3073.61
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 518.51
ACD/KOC (pH 7.4): 3045.66
Polar Surface Area: 74 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 277.0±3.0 cm3

Click to predict properties on the Chemicalize site


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