ChemSpider 2D Image | (1S)-1,5-Anhydro-1-[7-chloro-6-(4-propoxybenzyl)-2,3-dihydro-1-benzofuran-4-yl]-D-glucitol | C24H29ClO7

(1S)-1,5-Anhydro-1-[7-chloro-6-(4-propoxybenzyl)-2,3-dihydro-1-benzofuran-4-yl]-D-glucitol

  • Molecular FormulaC24H29ClO7
  • Average mass464.936 Da
  • Monoisotopic mass464.160187 Da
  • ChemSpider ID58904392

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-1-[7-chlor-6-(4-propoxybenzyl)-2,3-dihydro-1-benzofuran-4-yl]-D-glucitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-[7-chloro-6-(4-propoxybenzyl)-2,3-dihydro-1-benzofuran-4-yl]-D-glucitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-[7-chloro-6-(4-propoxybenzyl)-2,3-dihydro-1-benzofuran-4-yl]-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,5-anhydro-1-C-[7-chloro-2,3-dihydro-6-[(4-propoxyphenyl)methyl]-4-benzofuranyl]-, (1S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 661.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 353.7±31.5 °C
Index of Refraction: 1.621
Molar Refractivity: 119.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.83
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 283.09
ACD/KOC (pH 5.5): 1980.11
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 283.09
ACD/KOC (pH 7.4): 1980.10
Polar Surface Area: 109 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 339.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement