ChemSpider 2D Image | O-[3,5-Diiodo-4-(sulfooxy)phenyl]-3-iodo-L-tyrosine | C15H12I3NO7S

O-[3,5-Diiodo-4-(sulfooxy)phenyl]-3-iodo-L-tyrosine

  • Molecular FormulaC15H12I3NO7S
  • Average mass731.037 Da
  • Monoisotopic mass730.746826 Da
  • ChemSpider ID117527
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

L-Tyrosine, O-[3,5-diiodo-4-(sulfooxy)phenyl]-3-iodo- [ACD/Index Name]
O-[3,5-Diiod-4-(sulfooxy)phenyl]-3-iod-L-tyrosin [German] [ACD/IUPAC Name]
O-[3,5-Diiodo-4-(sulfooxy)phenyl]-3-iodo-L-tyrosine [ACD/IUPAC Name]
O-[3,5-Diiodo-4-(sulfooxy)phényl]-3-iodo-L-tyrosine [French] [ACD/IUPAC Name]
(2S)-2-amino-3-[4-(3,5-diiodo-4-sulfooxyphenoxy)-3-iodophenyl]propanoic acid
79349-15-8 [RN]
L-Tyrosine, O-(3,5-diiodo-4-(sulfooxy)phenyl)-3-iodo-
Reverse T3 sulfate
TRIIODOTHYRONINE, REVERSE SULFATE
Triiodothyronine, reverse-4-sulfate

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

Density: 2.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.757
Molar Refractivity: 123.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.07
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 83.1±3.0 dyne/cm
Molar Volume: 300.3±3.0 cm3

Click to predict properties on the Chemicalize site






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