ChemSpider 2D Image | N~3~-[(2R)-2-Hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-pentyl-beta-alaninamide | C14H29N2O7P

N3-[(2R)-2-Hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-pentyl-β-alaninamide

  • Molecular FormulaC14H29N2O7P
  • Average mass368.363 Da
  • Monoisotopic mass368.171234 Da
  • ChemSpider ID35034833

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Butanamide, 2-hydroxy-3,3-dimethyl-N-[3-oxo-3-(pentylamino)propyl]-4-(phosphonooxy)-, (2R)- [ACD/Index Name]
N3-[(2R)-2-Hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-pentyl-β-alaninamid [German] [ACD/IUPAC Name]
N3-[(2R)-2-Hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-pentyl-β-alaninamide [ACD/IUPAC Name]
N3-[(2R)-2-Hydroxy-3,3-diméthyl-4-(phosphonooxy)butanoyl]-N-pentyl-β-alaninamide [French] [ACD/IUPAC Name]
2GH

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.504
Molar Refractivity: 87.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: -0.45
ACD/LogD (pH 5.5): -3.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 295.0±3.0 cm3

Click to predict properties on the Chemicalize site


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