ChemSpider 2D Image | m-chloro-β-hydroxytyrosine | C9H10ClNO4

m-chloro-β-hydroxytyrosine

  • Molecular FormulaC9H10ClNO4
  • Average mass231.633 Da
  • Monoisotopic mass231.029831 Da
  • ChemSpider ID25938524

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

3-Chloro-β-hydroxy-L-tyrosine [ACD/IUPAC Name]
3-Chloro-β-hydroxy-L-tyrosine [French] [ACD/IUPAC Name]
3-Chlor-β-hydroxy-L-tyrosin [German] [ACD/IUPAC Name]
L-Tyrosine, 3-chloro-β-hydroxy- [ACD/Index Name]
m-chloro-β-hydroxytyrosine
3-chloro-??-hydroxytyrosine
m-chloro-ß-hydroxytyrosine
ß-hydroxy-m-chlorotyrosine

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

Density: 1.6±0.1 g/cm3
Boiling Point: 466.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 235.6±28.7 °C
Index of Refraction: 1.658
Molar Refractivity: 53.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 0.21
ACD/LogD (pH 5.5): -2.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 80.9±3.0 dyne/cm
Molar Volume: 146.1±3.0 cm3

Click to predict properties on the Chemicalize site


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