ChemSpider 2D Image | (-)-befunolol | C16H21NO4

(-)-befunolol

  • Molecular FormulaC16H21NO4
  • Average mass291.342 Da
  • Monoisotopic mass291.147064 Da
  • ChemSpider ID32697633

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(-)-befunolol
1-{7-[(2S)-2-Hydroxy-3-(isopropylamino)propoxy]-1-benzofuran-2-yl}ethanon [German] [ACD/IUPAC Name]
1-{7-[(2S)-2-Hydroxy-3-(isopropylamino)propoxy]-1-benzofuran-2-yl}ethanone [ACD/IUPAC Name]
1-{7-[(2S)-2-Hydroxy-3-(isopropylamino)propoxy]-1-benzofuran-2-yl}éthanone [French] [ACD/IUPAC Name]
66685-76-5 [RN]
Ethanone, 1-[7-[(2S)-2-hydroxy-3-[(1-methylethyl)amino]propoxy]-2-benzofuranyl]- [ACD/Index Name]
1-{7-[(2S)-2-HYDROXY-3-[(PROPAN-2-YL)AMINO]PROPOXY]-1-BENZOFURAN-2-YL}ETHAN-1-ONE
39552-01-7 [RN]
Befunolol [INN] [Wiki]
BEFUNOLOL, (-)-
More...

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

4WII3262ZC [DBID]
UNII:4WII3262ZC [DBID]
UNII-4WII3262ZC [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 459.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 231.6±28.7 °C
Index of Refraction: 1.560
Molar Refractivity: 81.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): -1.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.28
Polar Surface Area: 72 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 251.5±3.0 cm3

Click to predict properties on the Chemicalize site


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