ChemSpider 2D Image | 1,5-Anhydro-1-{4-chloro-3-[4-(tetrahydro-3-furanyloxy)benzyl]phenyl}hexitol | C23H27ClO7

1,5-Anhydro-1-{4-chloro-3-[4-(tetrahydro-3-furanyloxy)benzyl]phenyl}hexitol

  • Molecular FormulaC23H27ClO7
  • Average mass450.909 Da
  • Monoisotopic mass450.144531 Da
  • ChemSpider ID30922963

More details:

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

1,5-Anhydro-1-{4-chlor-3-[4-(tetrahydro-3-furanyloxy)benzyl]phenyl}hexitol [German] [ACD/IUPAC Name]
1,5-Anhydro-1-{4-chloro-3-[4-(tetrahydro-3-furanyloxy)benzyl]phenyl}hexitol [ACD/IUPAC Name]
1,5-Anhydro-1-{4-chloro-3-[4-(tétrahydro-3-furanyloxy)benzyl]phényl}hexitol [French] [ACD/IUPAC Name]
Hexitol, 1,5-anhydro-1-C-[4-chloro-3-[[4-[(tetrahydro-3-furanyl)oxy]phenyl]methyl]phenyl]- [ACD/Index Name]
(2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Empagliflozin [INN] [USAN] [Wiki]
Empagliflozin (BI 10773)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 664.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.7±3.0 kJ/mol
Flash Point: 355.7±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 114.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.38
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.96
ACD/KOC (pH 5.5): 522.06
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.96
ACD/KOC (pH 7.4): 522.06
Polar Surface Area: 109 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 322.4±3.0 cm3

Click to predict properties on the Chemicalize site


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