Deprecated ChemSpider Record

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ChemSpider 2D Image | CSID:21429446 | C36H66N6O24

  • Molecular FormulaC36H66N6O24
  • Average mass966.935 Da
  • Monoisotopic mass966.413025 Da
  • ChemSpider ID21429446

Date of deprecation: 15:13, Jul 23, 2013
Reason for deprecation: Deprecate record: prospect error -missing stereochem

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

Density: 1.5±0.0 g/cm3
Boiling Point: 1329.9±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 225.5±0.0 kJ/mol
Flash Point: 758.1±0.0 °C
Index of Refraction: 1.589
Molar Refractivity: 214.4±0.0 cm3
#H bond acceptors: 30
#H bond donors: 24
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 3
ACD/LogP: -7.42
ACD/LogD (pH 5.5): -15.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -15.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 510 Å2
Polarizability: 85.0±0.0 10-24cm3
Surface Tension: 68.5±0.0 dyne/cm
Molar Volume: 636.0±0.0 cm3

Click to predict properties on the Chemicalize site


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