ChemSpider 2D Image | 6-Acetyl-2,8-dihydroxy-3,7,11,12-tetramethoxy-5-methyl-4,10-dihydro-1H-cyclohepta[ghi]perylene-1,9(2H)-dione | C30H26O9

6-Acetyl-2,8-dihydroxy-3,7,11,12-tetramethoxy-5-methyl-4,10-dihydro-1H-cyclohepta[ghi]perylene-1,9(2H)-dione

  • Molecular FormulaC30H26O9
  • Average mass530.522 Da
  • Monoisotopic mass530.157654 Da
  • ChemSpider ID116677

More details:






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

1H-Cyclohepta[ghi]perylene-1,9(2H)-dione, 6-acetyl-4,10-dihydro-2,8-dihydroxy-3,7,11,12-tetramethoxy-5-methyl- [ACD/Index Name]
6-Acetyl-2,8-dihydroxy-3,7,11,12-tetramethoxy-5-methyl-4,10-dihydro-1H-cyclohepta[ghi]perylen-1,9(2H)-dion [German] [ACD/IUPAC Name]
6-Acetyl-2,8-dihydroxy-3,7,11,12-tetramethoxy-5-methyl-4,10-dihydro-1H-cyclohepta[ghi]perylene-1,9(2H)-dione [ACD/IUPAC Name]
6-Acétyl-2,8-dihydroxy-3,7,11,12-tétraméthoxy-5-méthyl-4,10-dihydro-1H-cyclohepta[ghi]pérylène-1,9(2H)-dione [French] [ACD/IUPAC Name]
137592-26-8 [RN]
19-Acetyl-13,21-dihydroxy-7,9,14,20-tetramethoxy-17-methylhexacyclo[13.8.0.02,11.03,8.04,22.018,23]tricosa-1(23),2(11),3,7,9,14,17,19,21-nonaene-5,12-dione
Hypocrellin C

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

Density: 1.5±0.1 g/cm3
Boiling Point: 923.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 152.5±6.0 kJ/mol
Flash Point: 310.8±27.8 °C
Index of Refraction: 1.685
Molar Refractivity: 134.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.27
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.23
ACD/LogD (pH 7.4): -3.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 66.4±5.0 dyne/cm
Molar Volume: 353.4±5.0 cm3

Click to predict properties on the Chemicalize site






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