Found 22 results

Search term: MF = 'C_{13}H_{17}I_{2}NO_{3}'
ChemSpider 2D Image | 2-Methyl-2-propanyl 3,5-diiodo-D-tyrosinate | C13H17I2NO3

2-Methyl-2-propanyl 3,5-diiodo-D-tyrosinate

  • Molecular FormulaC13H17I2NO3
  • Average mass489.088 Da
  • Monoisotopic mass488.929749 Da
  • ChemSpider ID114864767

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Methyl-2-propanyl 3,5-diiodo-D-tyrosinate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3,5-diiod-D-tyrosinat [German] [ACD/IUPAC Name]
3,5-Diiodo-D-tyrosinate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
D-Tyrosine, 3,5-diiodo-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 404.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.1±3.0 kJ/mol
Flash Point: 198.3±28.7 °C
Index of Refraction: 1.640
Molar Refractivity: 91.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 38.70
ACD/KOC (pH 5.5): 244.54
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 93.66
ACD/KOC (pH 7.4): 591.81
Polar Surface Area: 73 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 254.9±3.0 cm3

Click to predict properties on the Chemicalize site


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