ChemSpider 2D Image | 1-Carboxy-2-(4-ethynylphenyl)ethanaminium | C11H12NO2

1-Carboxy-2-(4-ethynylphenyl)ethanaminium

  • Molecular FormulaC11H12NO2
  • Average mass190.218 Da
  • Monoisotopic mass190.086258 Da
  • ChemSpider ID77420313

  • Charge - Charge

More details:

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

1-Carboxy-2-(4-ethinylphenyl)ethanaminium [German] [ACD/IUPAC Name]
1-Carboxy-2-(4-ethynylphenyl)ethanaminium [ACD/IUPAC Name]
1-Carboxy-2-(4-éthynylphényl)éthanaminium [French] [ACD/IUPAC Name]
Phenylalanine, 4-ethynyl-, conjugate acid [ACD/Index Name]

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

Density:
Boiling Point: 343.2±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.0±3.0 kJ/mol
Flash Point: 161.4±26.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.29
ACD/LogD (pH 5.5): -1.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 65 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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