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Found 1 result

Search term: YIJKJXQMGVZDJQ (Found by InChIKey (skeleton match))

ChemSpider 2D Image | Dimethyl (2R,2'R)-2,2'-[2,6-pyridinediylbis(carbonylimino)]bis(phenylacetate) | C25H23N3O6

Dimethyl (2R,2'R)-2,2'-[2,6-pyridinediylbis(carbonylimino)]bis(phenylacetate)

  • Molecular FormulaC25H23N3O6
  • Average mass461.467 Da
  • Monoisotopic mass461.158691 Da
  • ChemSpider ID29271912
  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,2'R)-2,2'-[2,6-Pyridinediylbis(carbonylimino)]bis(phénylacétate) de diméthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, α,α'-[2,6-pyridinediylbis(carbonylimino)]bis-, dimethyl ester, (αR)- [ACD/Index Name]
Dimethyl (2R,2'R)-2,2'-[2,6-pyridinediylbis(carbonylimino)]bis(phenylacetate) [ACD/IUPAC Name]
Dimethyl-(2R,2'R)-2,2'-[2,6-pyridindiylbis(carbonylimino)]bis(phenylacetat) [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 731.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.7±3.0 kJ/mol
Flash Point: 396.1±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 122.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 83.02
ACD/KOC (pH 5.5): 822.96
ACD/LogD (pH 7.4): 2.83
ACD/BCF (pH 7.4): 83.01
ACD/KOC (pH 7.4): 822.85
Polar Surface Area: 124 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 359.2±3.0 cm3

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