Cas no 149471-23-8 (1,5,10,16,21,27,32,38-Octaazacyclodotetracontane-6,9,17,20,28,31,39,42-octone,1,10,21,32-tetrahydroxy-)

1,5,10,16,21,27,32,38-Octaazacyclodotetracontane-6,9,17,20,28,31,39,42-octone,1,10,21,32-tetrahydroxy- structure
149471-23-8 structure
Product Name:1,5,10,16,21,27,32,38-Octaazacyclodotetracontane-6,9,17,20,28,31,39,42-octone,1,10,21,32-tetrahydroxy-
CAS No:149471-23-8
MF:C34H60N8O12
MW:772.886609077454
CID:168315
Update Time:2024-01-25

1,5,10,16,21,27,32,38-Octaazacyclodotetracontane-6,9,17,20,28,31,39,42-octone,1,10,21,32-tetrahydroxy- Chemical and Physical Properties

Names and Identifiers

    • 1,5,10,16,21,27,32,38-Octaazacyclodotetracontane-6,9,17,20,28,31,39,42-octone,1,10,21,32-tetrahydroxy-
    • ProferrioxamineT3
    • 1,5,10,16,21,27,32,38-Octaazacyclodotetracontane-6,9,17,20,28,31,39,42-octone, 1,10,21,32-tetrahydroxy-
    • Inchi: 1S/C34H60N8O12/c43-27-11-16-32(48)40(52)24-8-3-6-21-37-29(45)13-18-34(50)42(54)26-10-22-38-30(46)14-17-33(49)41(53)25-9-2-5-20-36-28(44)12-15-31(47)39(51)23-7-1-4-19-35-27/h51-54H,1-26H2,(H,35,43)(H,36,44)(H,37,45)(H,38,46)
    • InChI Key: SQHCOHRLKBSORT-UHFFFAOYSA-N
    • SMILES: N1(O)C(=O)CCC(=O)NCCCCCN(O)C(=O)CCC(=O)NCCCCCN(O)C(=O)CCC(=O)NCCCCCN(O)C(=O)CCC(=O)NCCC1

Experimental Properties

  • Density: 1.182±0.06 g/cm3(Predicted)
  • pka: 9.06±0.20(Predicted)
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