ChemSpider 2D Image | (R,R)-(+/-)-denitronipradilol | C15H23NO4

(R,R)-(±)-denitronipradilol

  • Molecular FormulaC15H23NO4
  • Average mass281.347 Da
  • Monoisotopic mass281.162720 Da
  • ChemSpider ID58827964
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(3R)-8-[(2R)-2-Hydroxy-3-(isopropylamino)propoxy]-3-chromanol [German] [ACD/IUPAC Name]
(3R)-8-[(2R)-2-Hydroxy-3-(isopropylamino)propoxy]-3-chromanol [ACD/IUPAC Name]
(3R)-8-[(2R)-2-Hydroxy-3-(isopropylamino)propoxy]-3-chromanol [French] [ACD/IUPAC Name]
(R,R)-(±)-denitronipradilol
100922-05-2 [RN]
2H-1-Benzopyran-3-ol, 3,4-dihydro-8-[(2R)-2-hydroxy-3-[(1-methylethyl)amino]propoxy]-, (3R)- [ACD/Index Name]
DENITRONIPRADILOL, (R,R)-(±)-

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

S6W2UB5KND [DBID]
UNII:S6W2UB5KND [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: 480.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 244.3±28.7 °C
Index of Refraction: 1.556
Molar Refractivity: 76.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -1.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.48
Polar Surface Area: 71 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 237.9±3.0 cm3

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