Found 16 results

Search term: MF = 'C_{54}H_{76}N_{2}O_{9}'

ChemSpider 2D Image | CSID:8209254 | C54H76N2O9

  • Molecular FormulaC54H76N2O9
  • Average mass897.189 Da
  • Monoisotopic mass896.555054 Da
  • ChemSpider ID8209254
  • defined stereocentres - 20 of 22 defined stereocentres


More details:






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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 243.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 4
ACD/LogP: 7.57
ACD/LogD (pH 5.5): 7.32
ACD/BCF (pH 5.5): 216949.45
ACD/KOC (pH 5.5): 229693.06
ACD/LogD (pH 7.4): 7.32
ACD/BCF (pH 7.4): 217284.86
ACD/KOC (pH 7.4): 230048.17
Polar Surface Area: 164 Å2
Polarizability: 96.4±0.5 10-24cm3
Surface Tension: 68.3±5.0 dyne/cm
Molar Volume: 664.7±5.0 cm3

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