Deferasirox-d4 (major)(Mixture of 6-hydroxyphenyl-d4 isomers)

• Synonyms:

  4-[5-(2-Hydroxyphenyl)-3-(6-hydroxyphenyl-2,3,4,5-d4)-1H-1,2,4-triazol-1-yl]benzoic Acid & 4-[3-(2-hydroxyphenyl)-5-(6-hydroxyphenyl-2,3,4,5-d4)-1H-1,2,4-triazol-1-yl]benzoic Acid (1:1);

• Hazard Statement:

  No Data Available

• Smiles:

  [2H]c1c([2H])c([2H])c(c(O)c1[2H])c2nc(c3ccccc3O)n(n2)c4ccc(cc4)C(=O)O.[2H]c5c([2H])c([2H])c(c(O)c5[2H])c6nc(nn6c7ccc(cc7)C(=O)O)c8ccccc8O

• Molecular Formula:

  2 C21 D4 H11 N3 O4

• Molecular Weight:

  754.772

• InChI:

  InChI=1S/2C21H15N3O4/c2*25-17-7-3-1-5-15(17)19-22-20(16-6-2-4-8-18(16)26)24(23-19)14-11-9-13(10-12-14)21(27)28/h2*1-12,25-26H,(H,27,28)/i2D,4D,6D,8D;1D,3D,5D,7D

• Additionnal Information:

  IUPAC name: 4-[3-(2-hydroxyphenyl)-5-(2,3,4,5-tetradeuterio-6-hydroxyphenyl)-1,2,4-triazol-1-yl]benzoic acid;4-[5-(2-hydroxyphenyl)-3-(2,3,4,5-tetradeuterio-6-hydroxyphenyl)-1,2,4-triazol-1-yl]benzoic acid

• Shipping Conditions:

  Room Temperature