ChemSpider 2D Image | 4-Ethynyl-D-phenylalanine | C11H11NO2

4-Ethynyl-D-phenylalanine

  • Molecular FormulaC11H11NO2
  • Average mass189.210 Da
  • Monoisotopic mass189.078979 Da
  • ChemSpider ID75184853

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-Ethinyl-D-phenylalanin [German] [ACD/IUPAC Name]
4-Ethynyl-D-phenylalanine [ACD/IUPAC Name]
4-Éthynyl-D-phénylalanine [French] [ACD/IUPAC Name]
D-Phenylalanine, 4-ethynyl- [ACD/Index Name]
(2R)-2-amino-3-(4-ethynylphenyl)propanoic acid
1344438-37-4 [RN]
MFCD21358487

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

Density: 1.2±0.1 g/cm3
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: 1.595
Molar Refractivity: 53.0±0.4 cm3
#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: 63 Å2
Polarizability: 21.0±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 155.8±5.0 cm3

Click to predict properties on the Chemicalize site


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