Found 17 results

Search term: MF = 'C_{21}H_{27}ClO_{7}'
ChemSpider 2D Image | 1-C-[4-Chloro-3-(4-ethoxybenzyl)phenyl]-D-xylo-hexitol | C21H27ClO7

1-C-[4-Chloro-3-(4-ethoxybenzyl)phenyl]-D-xylo-hexitol

  • Molecular FormulaC21H27ClO7
  • Average mass426.888 Da
  • Monoisotopic mass426.144531 Da
  • ChemSpider ID107444097

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

1-C-[4-Chlor-3-(4-ethoxybenzyl)phenyl]-D-xylo-hexitol [German] [ACD/IUPAC Name]
1-C-[4-Chloro-3-(4-ethoxybenzyl)phenyl]-D-xylo-hexitol [ACD/IUPAC Name]
1-C-[4-Chloro-3-(4-éthoxybenzyl)phényl]-D-xylo-hexitol [French] [ACD/IUPAC Name]
D-xylo-Hexitol, 1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]- [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: 717.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.1±3.0 kJ/mol
Flash Point: 387.8±32.9 °C
Index of Refraction: 1.627
Molar Refractivity: 108.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.37
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.44
ACD/KOC (pH 5.5): 45.25
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.44
ACD/KOC (pH 7.4): 45.25
Polar Surface Area: 131 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 307.4±3.0 cm3

Click to predict properties on the Chemicalize site


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