Found 175 results

Search term: MF = 'C_{18}H_{23}BN_{2}O_{4}'
ChemSpider 2D Image | [5-({[(1R,2R)-2-(Benzoylamino)cyclohexyl]amino}methyl)-2-furyl]boronic acid | C18H23BN2O4

[5-({[(1R,2R)-2-(Benzoylamino)cyclohexyl]amino}methyl)-2-furyl]boronic acid

  • Molecular FormulaC18H23BN2O4
  • Average mass342.197 Da
  • Monoisotopic mass342.175079 Da
  • ChemSpider ID72981154

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[5-({[(1R,2R)-2-(Benzoylamino)cyclohexyl]amino}methyl)-2-furyl]boronic acid [ACD/IUPAC Name]
[5-({[(1R,2R)-2-(Benzoylamino)cyclohexyl]amino}methyl)-2-furyl]borsäure [German] [ACD/IUPAC Name]
Acide [5-({[(1R,2R)-2-(benzoylamino)cyclohexyl]amino}méthyl)-2-furyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[5-[[[(1R,2R)-2-(benzoylamino)cyclohexyl]amino]methyl]-2-furanyl]- [ACD/Index 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: 1.592
Molar Refractivity: 92.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.81
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 5.39
ACD/KOC (pH 7.4): 78.96
Polar Surface Area: 95 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 274.2±5.0 cm3

Click to predict properties on the Chemicalize site


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