ChemSpider 2D Image | 3-Hydroxy-5-(methylsulfanyl)-L-norvaline | C6H13NO3S

3-Hydroxy-5-(methylsulfanyl)-L-norvaline

  • Molecular FormulaC6H13NO3S
  • Average mass179.237 Da
  • Monoisotopic mass179.061615 Da
  • ChemSpider ID98390091

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

3-Hydroxy-5-(methylsulfanyl)-L-norvalin [German] [ACD/IUPAC Name]
3-Hydroxy-5-(methylsulfanyl)-L-norvaline [ACD/IUPAC Name]
3-Hydroxy-5-(méthylsulfanyl)-L-norvaline [French] [ACD/IUPAC Name]
L-Norvaline, 3-hydroxy-5-(methylthio)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 373.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.8±6.0 kJ/mol
Flash Point: 179.4±27.9 °C
Index of Refraction: 1.556
Molar Refractivity: 44.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): -2.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 138.1±3.0 cm3

Click to predict properties on the Chemicalize site


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