ChemSpider 2D Image | (R)-broxaterol | C9H15BrN2O2

(R)-broxaterol

  • Molecular FormulaC9H15BrN2O2
  • Average mass263.132 Da
  • Monoisotopic mass262.031677 Da
  • ChemSpider ID34995802

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-1-(3-Brom-1,2-oxazol-5-yl)-2-[(2-methyl-2-propanyl)amino]ethanol [German] [ACD/IUPAC Name]
(1R)-1-(3-Bromo-1,2-oxazol-5-yl)-2-[(2-methyl-2-propanyl)amino]ethanol [ACD/IUPAC Name]
(1R)-1-(3-Bromo-1,2-oxazol-5-yl)-2-[(2-méthyl-2-propanyl)amino]éthanol [French] [ACD/IUPAC Name]
(R)-broxaterol
104164-30-9 [RN]
5-Isoxazolemethanol, 3-bromo-α-[[(1,1-dimethylethyl)amino]methyl]-, (αR)- [ACD/Index Name]
278-494-4 [EINECS]
76596-57-1 [RN]
Broxaterol [INN] [Wiki]
BROXATEROL, (R)-
More...

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

OEO4W95R3Y [DBID]
UNII:OEO4W95R3Y [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 370.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 177.9±26.5 °C
Index of Refraction: 1.525
Molar Refractivity: 57.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): -2.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.05
Polar Surface Area: 58 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 187.6±3.0 cm3

Click to predict properties on the Chemicalize site


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