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Catalog CCR1334179859
CAS 1334179-85-9
IUPAC Name 2-[4-[[Bis[(1-tert-butyltriazol-4-yl)methyl]amino]methyl]triazol-1-yl]acetic acid
Molecular Weight 430.5
Molecular Formula C19H30N10O2
Canonical SMILES CC(C)(C)N1C=C(N=N1)CN(CC2=CN(N=N2)CC(=O)O)CC3=CN(N=N3)C(C)(C)C
InChI InChI=1S/C19H30N10O2/c1-18(2,3)28-11-15(21-24-28)8-26(7-14-10-27(23-20-14)13-17(30)31)9-16-12-29(25-22-16)19(4,5)6/h10-12H,7-9,13H2,1-6H3,(H,30,31)
InChI Key MGQYHUDOWOGSQI-UHFFFAOYSA-N
Boiling Point 620.7±65.0 °C(Predicted)
Purity 95%+ (HPLC)
Density 1.32±0.1 g/cm3(Predicted)
Solubility Soluble in DMSO, DMF, MeOH
Appearance Solid
Application CuAAC Click Reaction
Storage 4 °C
Complexity 574
Exact Mass 430.25532024
Monoisotopic Mass 430.25532024
pKa 3.33±0.10(Predicted)
Topological Polar Surface Area 133Ų

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