Chemical Properties of 3,5-Diiodo-L-tyrosine (CAS 300-39-0)

3,5-Diiodo-L-tyrosine

InChI
InChI=1S/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m1/s1
InChI Key
NYPYHUZRZVSYKL-SSDOTTSWSA-N
Formula
C9H9I2NO3
SMILES
NC(Cc1cc(I)c(O)c(I)c1)C(=O)O
Molecular Weight1
432.98
CAS
300-39-0
Other Names
  • 2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid
  • 3,5-Diiodotyrocine
  • 3,5-Iodo-L-tyrosine
  • 3,5-L-Diiodotyrosine
  • DIT (amino acid)
  • L-3,5-Diiodotyrosine
  • L-Tyrosine, 3,5-diiodo-
  • NSC 4143
  • Tryosine, 3,5-diiodo-
  • Tyrosine, 3,5-diiodo-, L-
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Physical Properties

Property Value Unit Source
ΔfusH° 38.74 kJ/mol Joback Calculated Property
IE 8.19 eV Relay (1.0) Calculated Property
log10WS -2.86 Aq. Solubility Prediction
logPoct/wat 1.556 Crippen Calculated Property
McVol 188.840 ml/mol McGowan Calculated Property
Tfus 557.60 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [434.23; 491.81] J/mol×K [926.66; 1214.97] Show Hide
Cp,gas 434.23 J/mol×K 926.66 Joback Calculated Property
Cp,gas 442.61 J/mol×K 974.71 Joback Calculated Property
Cp,gas 451.19 J/mol×K 1022.76 Joback Calculated Property
Cp,gas 460.19 J/mol×K 1070.81 Joback Calculated Property
Cp,gas 469.81 J/mol×K 1118.87 Joback Calculated Property
Cp,gas 480.28 J/mol×K 1166.92 Joback Calculated Property
Cp,gas 491.81 J/mol×K 1214.97 Joback Calculated Property

Similar Compounds

Alanine, (3,5-diiodo-4-(-p-hydroxyphenoxy)phenyl)-. Tyrosine. 2-Amino-3-(4-hydroxyphenyl)-propanoic acid. Levodopa. Dihydroxyphenylalanine. Propanoic acid, 2-amino,3-[3,5-diiodo-4-[4-hydroxy-3-(1-methylethyl)phenoxy]phenyl]-. N-methyl tyrosine. DL-3-hydroxyphenylalanine. 3-(p-hydroxyphenyl)-L-alanine. L-tyrosine, n-benzoyl-3,5-diiodo-, ethyl ester. 3-Iodo-L-tyrosine, O-tert-butyldimethylsilyl-, tert-butyldimethylsilyl ester. 2-acetamido-3-(4-hydroxyphenyl)propanoic acid. Glycyl-L-tyrosine. Phenylalanine. DL-PHENYLALANINE.

Find more compounds similar to 3,5-Diiodo-L-tyrosine.

Sources

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