Found 9 results

Search term: MF = 'C_{43}H_{55}NO_{8}'
ChemSpider 2D Image | (2S,3S)-2-(Benzoylamino)-2-(methoxycarbonyl)-14-oxo-1,3-icosanediyl dibenzoate | C43H55NO8

(2S,3S)-2-(Benzoylamino)-2-(methoxycarbonyl)-14-oxo-1,3-icosanediyl dibenzoate

  • Molecular FormulaC43H55NO8
  • Average mass713.899 Da
  • Monoisotopic mass713.392761 Da
  • ChemSpider ID8875348

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3S)-2-(Benzoylamino)-2-(methoxycarbonyl)-14-oxo-1,3-icosandiyl-dibenzoat [German] [ACD/IUPAC Name]
(2S,3S)-2-(Benzoylamino)-2-(methoxycarbonyl)-14-oxo-1,3-icosanediyl dibenzoate [ACD/IUPAC Name]
Dibenzoate de (2S,3S)-2-(benzoylamino)-2-(méthoxycarbonyl)-14-oxo-1,3-icosanediyle [French] [ACD/IUPAC Name]
Eicosanoic acid, 2-(benzoylamino)-3-(benzoyloxy)-2-[(benzoyloxy)methyl]-14-oxo-, methyl ester, (2S,3S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 819.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.1±3.0 kJ/mol
Flash Point: 449.5±34.3 °C
Index of Refraction: 1.540
Molar Refractivity: 201.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 28
#Rule of 5 Violations: 2
ACD/LogP: 13.60
ACD/LogD (pH 5.5): 11.34
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.34
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 125 Å2
Polarizability: 79.9±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 642.0±3.0 cm3

Click to predict properties on the Chemicalize site


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