Chemical Properties of HYDROXYEPHEDRINE, p-

HYDROXYEPHEDRINE, p-

InChI
InChI=1S/C10H15NO2/c1-7(11-2)10(13)8-3-5-9(12)6-4-8/h3-7,10-13H,1-2H3
InChI Key
OXFGTKPPFSCSMA-UHFFFAOYSA-N
Formula
C10H15NO2
SMILES
CNC(C)C(O)c1ccc(O)cc1
Molecular Weight1
181.24
Other Names
  • (R*,S*)-4-hydroxy-«alpha»-[1-(methylamino)ethyl]benzyl alcohol
  • 4-Hydroxyephedrine
  • Benzenemethanol, 4-hydroxy-«alpha»-[1-(methylamino)ethyl]-, (R*,S*)-
  • Benzyl alcohol, p-hydroxy-«alpha»-(1-(methylamino)ethyl)-
  • Ephedrine, p-hydroxy-
  • Hydroxyephedrine
  • Methylsympatol
  • Oxilofrine
  • Oxyephedrine
  • Suprifen
  • Suprifene
  • Supriphen
  • p-Hydroxyephedrine
  • p-Oxy-ephedrin
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Physical Properties

Property Value Unit Source
ΔfH°gas -269.45 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 23.62 kJ/mol Joback Calculated Property
ΔvapH° 101.16 kJ/mol Relay (1.0) Calculated Property
log10WS 0.20 Relay (1.0) Calculated Property
logPoct/wat 1.033 Crippen Calculated Property
McVol 149.720 ml/mol McGowan Calculated Property
Inp [1682.00; 1682.00]   Show Hide
Inp 1682.00 NIST
Inp 1682.00 NIST
Tboil 571.04 K Relay (1.0) Calculated Property
Tfus 426.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [205.31; 495.77] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-4.83100e+01
Coefficient B1.15154e+00
Coefficient C-8.93160e-04
Coefficient D2.85700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 205.31 J/mol×K 273.00 Calculated Property
Cp,gas 259.94 J/mol×K 353.78 Calculated Property
Cp,gas 306.88 J/mol×K 434.56 Calculated Property
Cp,gas 347.02 J/mol×K 515.33 Calculated Property
Cp,gas 381.27 J/mol×K 596.11 Calculated Property
Cp,gas 410.53 J/mol×K 676.89 Calculated Property
Cp,gas 435.71 J/mol×K 757.67 Calculated Property
Cp,gas 457.71 J/mol×K 838.44 Calculated Property
Cp,gas 477.43 J/mol×K 919.22 Calculated Property
Cp,gas 495.77 J/mol×K 1000.00 Calculated Property

Similar Compounds

[R-(R*,R*)]-«alpha»-[1-(methylamino)ethyl]benzyl alcohol. Ephedrine. Benzenemethanol, «alpha»-[1-(methylamino)ethyl]-. (+) threo-2-(methylamino)-1-phenyl-1-propanol (pseudoephedrine). DL-Ephedrine. 2-Ethylamino-1-phenylpropanol. ISOXUPRINE. Nylidrin. Suloctidil. Benzenemethanol, «alpha»-[1-(ethylmethylamino)ethyl]-, [R-(R*,S*)]-. ethylephedrine. Methylephedrine. (1S,2R)-(+)-N-METHYLEPHEDRINE. Ifenprodil. 1,2-Benzenediol, 4-[2-[[2-(1,3-benzodioxol-5-yl)-1-methylethyl]amino]-1-hydroxyethyl]-.

Find more compounds similar to HYDROXYEPHEDRINE, p-.

Sources

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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