Found 35 results

Search term: MF = 'C_{22}H_{28}N_{2}O_{11}'
ChemSpider 2D Image | (2R,3R,4R,5R)-6-[(5-Methyl-2-pyridinyl)amino]-6-oxo-1,2,3,4,5-hexanepentayl pentaacetate (non-preferred name) | C22H28N2O11

(2R,3R,4R,5R)-6-[(5-Methyl-2-pyridinyl)amino]-6-oxo-1,2,3,4,5-hexanepentayl pentaacetate (non-preferred name)

  • Molecular FormulaC22H28N2O11
  • Average mass496.465 Da
  • Monoisotopic mass496.169312 Da
  • ChemSpider ID62663973

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,3R,4R,5R)-6-[(5-Methyl-2-pyridinyl)amino]-6-oxo-1,2,3,4,5-hexanepentayl pentaacetate (non-preferred name) [ACD/IUPAC Name]
(2R,3R,4R,5R)-6-[(5-Methyl-2-pyridinyl)amino]-6-oxo-1,2,3,4,5-hexanpentayl-pentaacetat (non-preferred name) [German] [ACD/IUPAC Name]
Pentaacétate de (2R,3R,4R,5R)-6-[(5-méthyl-2-pyridinyl)amino]-6-oxo-1,2,3,4,5-hexanepentayle (non-preferred name) [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 642.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.0±31.5 °C
Index of Refraction: 1.525
Molar Refractivity: 117.0±0.3 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 2.34
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.58
ACD/KOC (pH 5.5): 247.96
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.69
ACD/KOC (pH 7.4): 249.76
Polar Surface Area: 173 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 382.0±3.0 cm3

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