4604-41-5

Name O-(4-hydroxy-3-iodophenyl)-3-iodo-L-tyrosine
CAS 4604-41-5
EINECS(EC#) 225-005-7
Molecular Formula C15H13I2NO4
MDL Number MFCD01863378
Molecular Weight 525.077
MOL File 4604-41-5.mol
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Chemical Properties

Appearance Off-White Powder
Melting point  178-180°C
Boiling point  520.7±50.0 °C(Predicted)
density  2.095±0.06 g/cm3(Predicted)
storage temp.  Amber Vial, -20°C Freezer, Under Inert Atmosphere
solubility  Aqueous Base (Slightly)
form  Solid
pka 2.17±0.20(Predicted)
color  Off-White to Beige
Stability: Light Sensitive
InChI InChI=1S/C15H13I2NO4/c16-10-7-9(2-3-13(10)19)22-14-4-1-8(5-11(14)17)6-12(18)15(20)21/h1-5,7,12,19H,6,18H2,(H,20,21)/t12-/m0/s1
InChIKey CPCJBZABTUOGNM-LBPRGKRZSA-N
SMILES C(O)(=O)[C@H](CC1=CC=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)N

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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