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Search term: RFQDLTYXNINJON-OYNZBZHQSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | [(1R)-2-(1-Benzofuran-3-yl)-1-{[(1S,2R,4R)-7-oxabicyclo[2.2.1]hept-2-ylcarbonyl]amino}ethyl]boronic acid | C17H20BNO5

[(1R)-2-(1-Benzofuran-3-yl)-1-{[(1S,2R,4R)-7-oxabicyclo[2.2.1]hept-2-ylcarbonyl]amino}ethyl]boronic acid

  • Molecular FormulaC17H20BNO5
  • Average mass329.155 Da
  • Monoisotopic mass329.143463 Da
  • ChemSpider ID72380107

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

[(1R)-2-(1-Benzofuran-3-yl)-1-{[(1S,2R,4R)-7-oxabicyclo[2.2.1]hept-2-ylcarbonyl]amino}ethyl]boronic acid [ACD/IUPAC Name]
[(1R)-2-(1-Benzofuran-3-yl)-1-{[(1S,2R,4R)-7-oxabicyclo[2.2.1]hept-2-ylcarbonyl]amino}ethyl]borsäure [German] [ACD/IUPAC Name]
Acide [(1R)-2-(1-benzofuran-3-yl)-1-{[(1S,2R,4R)-7-oxabicyclo[2.2.1]hept-2-ylcarbonyl]amino}éthyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[(1R)-2-(3-benzofuranyl)-1-[[(1S,2R,4R)-7-oxabicyclo[2.2.1]hept-2-ylcarbonyl]amino]ethyl]- [ACD/Index Name]
[(1R)-2-(1-benzofuran-3-yl)-1-[[(1S,2R,4R)-7-oxabicyclo[2.2.1]heptane-2-carbonyl]amino]ethyl]boronic acid
2285330-15-4 [RN]
LMP7-IN-1
M3258

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 85.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.61
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 10.56
ACD/KOC (pH 5.5): 188.10
ACD/LogD (pH 7.4): 1.65
ACD/BCF (pH 7.4): 10.51
ACD/KOC (pH 7.4): 187.23
Polar Surface Area: 92 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 247.8±3.0 cm3

Click to predict properties on the Chemicalize site


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