ChemSpider 2D Image | (1R)-1,4-Anhydro-6-deoxy-1-[(6R)-1,6-dihydroxy-10,12-dimethoxy-8-vinyl-6H-dibenzo[c,h]chromen-4-yl]-D-galactitol | C27H28O9

(1R)-1,4-Anhydro-6-deoxy-1-[(6R)-1,6-dihydroxy-10,12-dimethoxy-8-vinyl-6H-dibenzo[c,h]chromen-4-yl]-D-galactitol

  • Molecular FormulaC27H28O9
  • Average mass496.506 Da
  • Monoisotopic mass496.173340 Da
  • ChemSpider ID26329302

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R)-1,4-Anhydro-6-deoxy-1-[(6R)-1,6-dihydroxy-10,12-dimethoxy-8-vinyl-6H-dibenzo[c,h]chromen-4-yl]-D-galactitol [ACD/IUPAC Name]
(1r)-1,4-Anhydro-6-Deoxy-1-[(6r)-8-Ethenyl-1,6-Dihydroxy-10,12-Dimethoxy-6h-Dibenzo[c,H]chromen-4-Yl]-D-Galactitol
(1R)-1,4-Anhydro-6-desoxy-1-[(6R)-1,6-dihydroxy-10,12-dimethoxy-8-vinyl-6H-dibenzo[c,h]chromen-4-yl]-D-galactitol [German] [ACD/IUPAC Name]
(1R)-1,4-Anhydro-6-désoxy-1-[(6R)-1,6-dihydroxy-10,12-diméthoxy-8-vinyl-6H-dibenzo[c,h]chromén-4-yl]-D-galactitol [French] [ACD/IUPAC Name]
D-Galactitol, 1,4-anhydro-6-deoxy-1-C-[(6R)-8-ethenyl-1,6-dihydroxy-10,12-dimethoxy-6H-benzo[d]naphtho[1,2-b]pyran-4-yl]-, (1R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 823.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.5±3.0 kJ/mol
Flash Point: 452.0±34.3 °C
Index of Refraction: 1.706
Molar Refractivity: 133.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.10
ACD/KOC (pH 5.5): 407.49
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.16
ACD/KOC (pH 7.4): 395.07
Polar Surface Area: 138 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 71.5±3.0 dyne/cm
Molar Volume: 342.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement