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ChemSpider 2D Image | N-[3-(Dihydroxyboryl)phenyl]-2-methyl-N~2~-{[(2-methyl-2-propanyl)oxy]acetyl}alaninamide | C16H25BN2O5

N-[3-(Dihydroxyboryl)phenyl]-2-methyl-N2-{[(2-methyl-2-propanyl)oxy]acetyl}alaninamide

  • Molecular FormulaC16H25BN2O5
  • Average mass336.191 Da
  • Monoisotopic mass336.185638 Da
  • ChemSpider ID72869870

More details:






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

Boronic acid, B-[3-[[2-[[2-(1,1-dimethylethoxy)acetyl]amino]-2-methyl-1-oxopropyl]amino]phenyl]- [ACD/Index Name]
N-[3-(Dihydroxyboryl)phenyl]-2-methyl-N2-{[(2-methyl-2-propanyl)oxy]acetyl}alaninamid [German] [ACD/IUPAC Name]
N-[3-(Dihydroxyboryl)phenyl]-2-methyl-N2-{[(2-methyl-2-propanyl)oxy]acetyl}alaninamide [ACD/IUPAC Name]
N-[3-(Dihydroxyboryl)phényl]-2-méthyl-N2-{2-[(2-méthyl-2-propanyl)oxy]acétyl}alaninamide [French] [ACD/IUPAC Name]

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: 1.533
Molar Refractivity: 88.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.40
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 5.90
ACD/KOC (pH 5.5): 123.94
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 4.82
ACD/KOC (pH 7.4): 101.25
Polar Surface Area: 108 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 47.0±5.0 dyne/cm
Molar Volume: 286.5±5.0 cm3

Click to predict properties on the Chemicalize site






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