ChemSpider 2D Image | O-Methyl-N-[4-methyl-2-(sulfanylmethyl)pentanoyl]tyrosine | C17H25NO4S

O-Methyl-N-[4-methyl-2-(sulfanylmethyl)pentanoyl]tyrosine

  • Molecular FormulaC17H25NO4S
  • Average mass339.450 Da
  • Monoisotopic mass339.150421 Da
  • ChemSpider ID21395306

More details:

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

O-Methyl-N-[(2s)-4-Methyl-2-(Sulfanylmethyl)pentanoyl]-L-Tyrosine
O-Methyl-N-[4-methyl-2-(sulfanylmethyl)pentanoyl]tyrosin [German] [ACD/IUPAC Name]
O-Methyl-N-[4-methyl-2-(sulfanylmethyl)pentanoyl]tyrosine [ACD/IUPAC Name]
O-Méthyl-N-[4-méthyl-2-(sulfanylméthyl)pentanoyl]tyrosine [French] [ACD/IUPAC Name]
Tyrosine, N-[2-(mercaptomethyl)-4-methyl-1-oxopentyl]-O-methyl- [ACD/Index Name]
0QI

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

Density: 1.2±0.1 g/cm3
Boiling Point: 555.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 289.6±30.1 °C
Index of Refraction: 1.542
Molar Refractivity: 92.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.63
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 114 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 294.0±3.0 cm3

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