ChemSpider 2D Image | (2R)-2-Amino-3-(4',5-dihydroxy-3',4,5',6-tetraiodo-2-biphenylyl)propanoic acid | C15H11I4NO4

(2R)-2-Amino-3-(4',5-dihydroxy-3',4,5',6-tetraiodo-2-biphenylyl)propanoic acid

  • Molecular FormulaC15H11I4NO4
  • Average mass776.870 Da
  • Monoisotopic mass776.686646 Da
  • ChemSpider ID29273465
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2R)-2-Amino-3-(4',5-dihydroxy-3',4,5',6-tetraiod-2-biphenylyl)propansäure [German] [ACD/IUPAC Name]
(2R)-2-Amino-3-(4',5-dihydroxy-3',4,5',6-tetraiodo-2-biphenylyl)propanoic acid [ACD/IUPAC Name]
Acide (2R)-2-amino-3-(4',5-dihydroxy-3',4,5',6-tétraiodo-2-biphénylyl)propanoïque [French] [ACD/IUPAC Name]
L-Thyroxine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.7±0.1 g/cm3
Boiling Point: 578.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 303.7±30.1 °C
Index of Refraction: 1.822
Molar Refractivity: 125.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 1.76
ACD/BCF (pH 5.5): 3.00
ACD/KOC (pH 5.5): 13.73
ACD/LogD (pH 7.4): 0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 86.4±3.0 dyne/cm
Molar Volume: 287.9±3.0 cm3

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