ChemSpider 2D Image | (1R)-1,5-Anhydro-1-[4-chloro-5-(4-methoxybenzyl)-2,3-dihydro-1-benzofuran-7-yl]-L-glucitol | C22H25ClO7

(1R)-1,5-Anhydro-1-[4-chloro-5-(4-methoxybenzyl)-2,3-dihydro-1-benzofuran-7-yl]-L-glucitol

  • Molecular FormulaC22H25ClO7
  • Average mass436.883 Da
  • Monoisotopic mass436.128876 Da
  • ChemSpider ID76782149

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1R)-1,5-Anhydro-1-[4-chlor-5-(4-methoxybenzyl)-2,3-dihydro-1-benzofuran-7-yl]-L-glucitol [German] [ACD/IUPAC Name]
(1R)-1,5-Anhydro-1-[4-chloro-5-(4-methoxybenzyl)-2,3-dihydro-1-benzofuran-7-yl]-L-glucitol [ACD/IUPAC Name]
(1R)-1,5-Anhydro-1-[4-chloro-5-(4-méthoxybenzyl)-2,3-dihydro-1-benzofuran-7-yl]-L-glucitol [French] [ACD/IUPAC Name]
L-Glucitol, 1,5-anhydro-1-C-[4-chloro-2,3-dihydro-5-[(4-methoxyphenyl)methyl]-7-benzofuranyl]-, (1R)- [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: 639.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 340.3±31.5 °C
Index of Refraction: 1.638
Molar Refractivity: 110.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 3.00
ACD/BCF (pH 5.5): 112.77
ACD/KOC (pH 5.5): 1024.63
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 112.77
ACD/KOC (pH 7.4): 1024.63
Polar Surface Area: 109 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 306.7±3.0 cm3

Click to predict properties on the Chemicalize site


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