ChemSpider 2D Image | beta-Hydroxy-2-nitro-L-phenylalanine | C9H10N2O5

β-Hydroxy-2-nitro-L-phenylalanine

  • Molecular FormulaC9H10N2O5
  • Average mass226.186 Da
  • Monoisotopic mass226.058975 Da
  • ChemSpider ID57565180

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

L-Phenylalanine, β-hydroxy-2-nitro- [ACD/Index Name]
β-Hydroxy-2-nitro-L-phenylalanin [German] [ACD/IUPAC Name]
β-Hydroxy-2-nitro-L-phenylalanine [ACD/IUPAC Name]
β-Hydroxy-2-nitro-L-phénylalanine [French] [ACD/IUPAC Name]
(2S)-2-AMINO-3-HYDROXY-3-(2-NITROPHENYL)PROPANOIC ACID
??-(nitrophenyl) serine
52773-86-1 [RN]
β-Hydroxy-2-nitrophenylalanine [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 518.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 267.1±30.1 °C
Index of Refraction: 1.646
Molar Refractivity: 53.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): -2.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 81.1±3.0 dyne/cm
Molar Volume: 147.5±3.0 cm3

Click to predict properties on the Chemicalize site


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