ChemSpider 2D Image | L-beta-homotyrosine | C10H13NO3

L-β-homotyrosine

  • Molecular FormulaC10H13NO3
  • Average mass195.215 Da
  • Monoisotopic mass195.089539 Da
  • ChemSpider ID24608066

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Amino-4-(4-hydroxyphenyl)butanoic acid [ACD/IUPAC Name]
(3R)-3-Amino-4-(4-hydroxyphenyl)butansäure [German] [ACD/IUPAC Name]
Acide (3R)-3-amino-4-(4-hydroxyphényl)butanoïque [French] [ACD/IUPAC Name]
Benzenebutanoic acid, β-amino-4-hydroxy-, (βR)- [ACD/Index Name]
L-β-homotyrosine
(S)-3-Amino-4-(4-hydroxyphenyl)butyric acid
617704-57-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 402.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 197.1±25.9 °C
Index of Refraction: 1.598
Molar Refractivity: 52.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.59
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 61.5±3.0 dyne/cm
Molar Volume: 152.4±3.0 cm3

Click to predict properties on the Chemicalize site


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