ChemSpider 2D Image | N-Hexanoyl-L-valyl-N~1~-[(4S,5S,6R)-5-hydroxy-2,6-dimethyl-4-octanyl]-N~5~,N~5~-dimethyl-L-glutamamide | C28H54N4O5

N-Hexanoyl-L-valyl-N1-[(4S,5S,6R)-5-hydroxy-2,6-dimethyl-4-octanyl]-N5,N5-dimethyl-L-glutamamide

  • Molecular FormulaC28H54N4O5
  • Average mass526.752 Da
  • Monoisotopic mass526.409424 Da
  • ChemSpider ID35035868

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

L-Glutamamide, N-(1-oxohexyl)-L-valyl-N1-[(1S,2S,3R)-2-hydroxy-3-methyl-1-(2-methylpropyl)pentyl]-N5,N5-dimethyl- [ACD/Index Name]
N-Hexanoyl-L-valyl-N1-[(4S,5S,6R)-5-hydroxy-2,6-dimethyl-4-octanyl]-N5,N5-dimethyl-L-glutamamid [German] [ACD/IUPAC Name]
N-Hexanoyl-L-valyl-N1-[(4S,5S,6R)-5-hydroxy-2,6-dimethyl-4-octanyl]-N5,N5-dimethyl-L-glutamamide [ACD/IUPAC Name]
N-Hexanoyl-L-valyl-N1-[(4S,5S,6R)-5-hydroxy-2,6-diméthyl-4-octanyl]-N5,N5-diméthyl-L-glutamamide [French] [ACD/IUPAC Name]
N-Hexanoyl-L-Valyl-N1-[(4s,5s,6r)-5-Hydroxy-2,6-Dimethyloctan-4-Yl]-N5,N5-Dimethyl-L-Glutamamide

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

Density: 1.0±0.1 g/cm3
Boiling Point: 764.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 126.9±6.0 kJ/mol
Flash Point: 415.9±32.9 °C
Index of Refraction: 1.487
Molar Refractivity: 147.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 416.38
ACD/KOC (pH 5.5): 2609.95
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 416.38
ACD/KOC (pH 7.4): 2609.95
Polar Surface Area: 128 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 38.1±3.0 dyne/cm
Molar Volume: 513.0±3.0 cm3

Click to predict properties on the Chemicalize site


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