ChemSpider 2D Image | RABDOPHYLLIN H | C24H36O9

RABDOPHYLLIN H

  • Molecular FormulaC24H36O9
  • Average mass468.537 Da
  • Monoisotopic mass468.235931 Da
  • ChemSpider ID21468810

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(5β,6β,7β,8α,9β,10α,13α,14R,16β)-7,14,15,16-Tetrahydroxy-7,20-epoxykauran-6,17-diyl-diacetat [German] [ACD/IUPAC Name]
(5β,6β,7β,8α,9β,10α,13α,14R,16β)-7,14,15,16-Tetrahydroxy-7,20-epoxykaurane-6,17-diyl diacetate [ACD/IUPAC Name]
102641-82-7 [RN]
Diacétate de (5β,6β,7β,8α,9β,10α,13α,14R,16β)-7,14,15,16-tétrahydroxy-7,20-époxykaurane-6,17-diyle [French] [ACD/IUPAC Name]
RABDOPHYLLIN H
[(1R,2S,5R,6R,7S,8R,9S,10S,11R,18R)-10-Acetyloxy-6,7,9,18-tetrahydroxy-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl]methyl acetate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 607.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.5±6.0 kJ/mol
Flash Point: 202.3±25.0 °C
Index of Refraction: 1.599
Molar Refractivity: 114.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.20
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 28.56
ACD/KOC (pH 5.5): 383.36
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 28.55
ACD/KOC (pH 7.4): 383.32
Polar Surface Area: 143 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 65.3±5.0 dyne/cm
Molar Volume: 335.2±5.0 cm3

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