ChemSpider 2D Image | (2S)-N-Methyl-1-oxo-1-phenyl-2-propanaminium | C10H14NO

(2S)-N-Methyl-1-oxo-1-phenyl-2-propanaminium

  • Molecular FormulaC10H14NO
  • Average mass164.224 Da
  • Monoisotopic mass164.106995 Da
  • ChemSpider ID128919978

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-N-Methyl-1-oxo-1-phenyl-2-propanaminium [German] [ACD/IUPAC Name]
(2S)-N-Methyl-1-oxo-1-phenyl-2-propanaminium [ACD/IUPAC Name]
(2S)-N-Méthyl-1-oxo-1-phényl-2-propanaminium [French] [ACD/IUPAC Name]
1-Propanone, 2-(methylamino)-1-phenyl-, conjugate acid, (2S)- [ACD/Index Name]
(2S)-N-methyl-1-oxo-1-phenylpropan-2-aminium
(S)-2-methylamino-1-phenylpropan-1-one
(S)-methcathinone(1+)
(S)-N-methyl-1-oxo-1-phenylpropan-2-aminium
methyl-[(2S)-1-oxo-1-phenylpropan-2-yl]azanium
  • Miscellaneous

    • Chemical Class:

      An ammonium ion derivative that is the conjugate acid of (S)-methcathinone obtained from the protonation of the amino group. It is the major species at pH 7.3. ChEBI CHEBI:145731

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

Density:
Boiling Point: 254.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 102.5±22.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.68
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 5.39
ACD/KOC (pH 7.4): 102.57
Polar Surface Area: 34 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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