ChemSpider 2D Image | chloroacetyl-CoA | C23H37ClN7O17P3S

chloroacetyl-CoA

  • Molecular FormulaC23H37ClN7O17P3S
  • Average mass844.016 Da
  • Monoisotopic mass843.086792 Da
  • ChemSpider ID25941258
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

chloroacetyl-CoA

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.722
Molar Refractivity: 172.4±0.5 cm3
#H bond acceptors: 24
#H bond donors: 10
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: -3.66
ACD/LogD (pH 5.5): -10.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 418 Å2
Polarizability: 68.3±0.5 10-24cm3
Surface Tension: 100.0±7.0 dyne/cm
Molar Volume: 435.4±7.0 cm3

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