Found 51 results

Search term: MF = 'C_{31}H_{40}O_{10}'
ChemSpider 2D Image | 4,8-Diacetoxy-2,6,10-trihydroxy-3a-(2-hydroxy-2-propanyl)-1,8a-dimethyl-5-methylene-2,3,3a,4,4a,5,6,7,8,8a,9,10-dodecahydrobenzo[f]azulen-9-yl benzoate | C31H40O10

4,8-Diacetoxy-2,6,10-trihydroxy-3a-(2-hydroxy-2-propanyl)-1,8a-dimethyl-5-methylene-2,3,3a,4,4a,5,6,7,8,8a,9,10-dodecahydrobenzo[f]azulen-9-yl benzoate

  • Molecular FormulaC31H40O10
  • Average mass572.643 Da
  • Monoisotopic mass572.262146 Da
  • ChemSpider ID72391175

More details:

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

4,8-Diacetoxy-2,6,10-trihydroxy-3a-(2-hydroxy-2-propanyl)-1,8a-dimethyl-5-methylen-2,3,3a,4,4a,5,6,7,8,8a,9,10-dodecahydrobenzo[f]azulen-9-yl-benzoat [German] [ACD/IUPAC Name]
4,8-Diacetoxy-2,6,10-trihydroxy-3a-(2-hydroxy-2-propanyl)-1,8a-dimethyl-5-methylene-2,3,3a,4,4a,5,6,7,8,8a,9,10-dodecahydrobenzo[f]azulen-9-yl benzoate [ACD/IUPAC Name]
Benz[f]azulene-2,4,6,8,9,10-hexol, 2,3,3a,4,4a,5,6,7,8,8a,9,10-dodecahydro-3a-(1-hydroxy-1-methylethyl)-1,8a-dimethyl-5-methylene-, 4,8-diacetate 9-benzoate [ACD/Index Name]
Benzoate de 4,8-diacétoxy-2,6,10-trihydroxy-3a-(2-hydroxy-2-propanyl)-1,8a-diméthyl-5-méthylène-2,3,3a,4,4a,5,6,7,8,8a,9,10-dodécahydrobenzo[f]azulén-9-yle [French] [ACD/IUPAC Name]
172486-22-5 [RN]
9-Deacetyl-9-benzoyl-10-debenzoyltaxchinin A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 694.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 218.8±25.0 °C
Index of Refraction: 1.596
Molar Refractivity: 147.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 96.42
ACD/KOC (pH 5.5): 915.93
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 96.42
ACD/KOC (pH 7.4): 915.93
Polar Surface Area: 160 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 60.0±5.0 dyne/cm
Molar Volume: 431.8±5.0 cm3

Click to predict properties on the Chemicalize site


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