ChemSpider 2D Image | (S)-carazolol | C18H22N2O2

(S)-carazolol

  • Molecular FormulaC18H22N2O2
  • Average mass298.379 Da
  • Monoisotopic mass298.168121 Da
  • ChemSpider ID25057354

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(9H-Carbazol-4-yloxy)-3-(isopropylamino)-2-propanol [ACD/IUPAC Name]
(2S)-1-(9H-Carbazol-4-yloxy)-3-(isopropylamino)-2-propanol [German] [ACD/IUPAC Name]
(2S)-1-(9H-Carbazol-4-yloxy)-3-(isopropylamino)-2-propanol [French] [ACD/IUPAC Name]
(S)-carazolol
2-Propanol, 1-(9H-carbazol-4-yloxy)-3-[(1-methylethyl)amino]-, (2S)- [ACD/Index Name]
78859-33-3 [RN]
(-)-CARAZOLOL
(2R)-1-(9H-carbazol-4-yloxy)-3-(isopropylamino)propan-2-ol
(2R)-1-(9H-carbazol-4-yloxy)-3-(propan-2-ylamino)propan-2-ol
(2S)-1-(9H-Carbazol-4-yloxy)-3-(isopropylamino)propan-2-ol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

6Q9080LN3O [DBID]
UNII:6Q9080LN3O [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: 531.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 275.1±27.3 °C
Index of Refraction: 1.652
Molar Refractivity: 91.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.34
ACD/LogD (pH 7.4): 1.14
ACD/BCF (pH 7.4): 1.31
ACD/KOC (pH 7.4): 10.09
Polar Surface Area: 57 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 249.6±3.0 cm3

Click to predict properties on the Chemicalize site


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