tetra-tert-butyl 2,2',2'',2'''-(2-(4-aminobenzyl)-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)(S)-tetraacetate

Catalog No. :
ACNEXU512
CAS No. :
446061-19-4
Molecular Formula :
C39H67N5O8
Molecular Weight :
733.99

IUPAC Name:tetra-tert-butyl 2,2',2'',2'''-(2-(4-aminobenzyl)-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)(S)-tetraacetate

tetra-tert-butyl 2,2',2'',2'''-(2-(4-aminobenzyl)-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)(S)-tetraacetate structure diagram
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Product Information

Product Nametetra-tert-butyl 2,2',2'',2'''-(2-(4-aminobenzyl)-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)(S)-tetraacetate
IUPAC Nametetra-tert-butyl 2,2',2'',2'''-(2-(4-aminobenzyl)-1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)(S)-tetraacetate
Molecular FormulaC39H67N5O8
Molecular Weight733.99
SMILESCC(C)(C)OC(=O)CN1CCN(CC(=O)OC(C)(C)C)CCN(CC(=O)OC(C)(C)C)[C@@H](CC2=CC=C(N)C=C2)CN(CC(=O)OC(C)(C)C)CC1
InChI KeyVKRXEQDSGLUSBS-HKBQPEDESA-N
Synonympenta-t-butyl ((S)-2-(4-aminobenzyl)-1,4,7,10-tetraazacyclododecane-N,N’,N”,N”’-tetraacetic acid);p-NH2-Bn-DOTA-tetra(t-Butyl ester);DOTA-p-NH2-Bn-(COOt-Bu)4;p-NH?-Bn-DOTA-tetra(t-Bu ester);1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 2-[(4-aminophenyl)methyl]-, 1,4,7,10-tetrakis(1,1-dimethylethyl) ester, (2S)-
CAS No.446061-19-4

Safety Data

Pictogram
Harmful or irritant
Signal Word
Warning
Hazard Statement(s)
H315-H319-H335
Precautionary Statement(s)
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501

Synthetic Route by SureRoute

1. ACNEXU512 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACNEXU512 route product structure diagram
    ACNEXU512446061-19-4
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2. ACNEXU512 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACNEXU512 route product structure diagram
    ACNEXU512446061-19-4
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