ChemSpider 2D Image | T2 | C15H13I2NO4

T2

  • Molecular FormulaC15H13I2NO4
  • Average mass525.077 Da
  • Monoisotopic mass524.893372 Da
  • ChemSpider ID96777

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

225-005-7 [EINECS]
3,3'-??Diiodo-??4-??(4-??hydroxyphenoxy)??-L-phenylalanine
3,3'-diiodo-L-thyronine
3,3'-Diiodo-L-thyronine (T2)
3,3'-L-Diiodothyronine
4604-41-5 [RN]
L-3,3'-Diiodothyronine
L-Tyrosine, O-(4-hydroxy-3-iodophenyl)-3-iodo- [ACD/Index Name]
MFCD01863378 [MDL number]
O-(4-??Hydroxyphenyl)-3-,3'-??diiodo-L-tyrosine
More...

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

3L9U2Z4602 [DBID]
CCRIS 4693 [DBID]
CHEBI:35429 [DBID]
UNII:3L9U2Z4602 [DBID]
UNII-3L9U2Z4602 [DBID]

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

    Density: 2.1±0.1 g/cm3
    Boiling Point: 520.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 83.6±3.0 kJ/mol
    Flash Point: 268.7±30.1 °C
    Index of Refraction: 1.726
    Molar Refractivity: 99.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 4.55
    ACD/LogD (pH 5.5): 1.17
    ACD/BCF (pH 5.5): 1.14
    ACD/KOC (pH 5.5): 7.44
    ACD/LogD (pH 7.4): 1.12
    ACD/BCF (pH 7.4): 1.02
    ACD/KOC (pH 7.4): 6.67
    Polar Surface Area: 93 Å2
    Polarizability: 39.5±0.5 10-24cm3
    Surface Tension: 71.7±3.0 dyne/cm
    Molar Volume: 250.6±3.0 cm3

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