Found 95 results

Search term: MF = 'C_{23}H_{25}ClO_{6}'
ChemSpider 2D Image | (1S)-1,5-Anhydro-1-{3-[4-(2-butyn-1-yloxy)benzyl]-4-chlorophenyl}-D-glucitol | C23H25ClO6

(1S)-1,5-Anhydro-1-{3-[4-(2-butyn-1-yloxy)benzyl]-4-chlorophenyl}-D-glucitol

  • Molecular FormulaC23H25ClO6
  • Average mass432.894 Da
  • Monoisotopic mass432.133972 Da
  • ChemSpider ID26614235

  • 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-{3-[4-(2-butin-1-yloxy)benzyl]-4-chlorphenyl}-D-glucitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-{3-[4-(2-butyn-1-yloxy)benzyl]-4-chlorophenyl}-D-glucitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-{3-[4-(2-butyn-1-yloxy)benzyl]-4-chlorophényl}-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,5-anhydro-1-C-[3-[[4-(2-butyn-1-yloxy)phenyl]methyl]-4-chlorophenyl]-, (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: 653.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 349.0±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 112.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.49
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 148.11
ACD/KOC (pH 5.5): 1245.39
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 148.11
ACD/KOC (pH 7.4): 1245.39
Polar Surface Area: 99 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 319.4±3.0 cm3

Click to predict properties on the Chemicalize site


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