ChemSpider 2D Image | MFCD10569322 | C22H32O8

MFCD10569322

  • Molecular FormulaC22H32O8
  • Average mass424.485 Da
  • Monoisotopic mass424.209717 Da
  • ChemSpider ID22899745

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3R,6S,7S)-1,2,3,4,5,6,7,8-Octahydro-2,3,6,7-naphtalènetétracarboxylate de tétraéthyle [French] [ACD/IUPAC Name]
2,3,6,7-Naphthalenetetracarboxylic acid, 1,2,3,4,5,6,7,8-octahydro-, tetraethyl ester, (2R,3R,6S,7S)- [ACD/Index Name]
MFCD10569322
Tetraethyl (2R,3R,6S,7S)-1,2,3,4,5,6,7,8-octahydro-2,3,6,7-naphthalenetetracarboxylate [ACD/IUPAC Name]
Tetraethyl-(2R,3R,6S,7S)-1,2,3,4,5,6,7,8-octahydro-2,3,6,7-naphthalintetracarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 482.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.8±3.0 kJ/mol
Flash Point: 205.7±28.8 °C
Index of Refraction: 1.505
Molar Refractivity: 106.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 308.53
ACD/KOC (pH 5.5): 2105.91
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 308.53
ACD/KOC (pH 7.4): 2105.91
Polar Surface Area: 105 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 44.0±5.0 dyne/cm
Molar Volume: 359.6±5.0 cm3

Click to predict properties on the Chemicalize site


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