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Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%

PurissAvailable on request

Order Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97% (CAS 122555-91-3) online at Zemixal…

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Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97% chemical structure
CAS number122555-91-3
FormulaC26H50N4O6
Molar mass514.7 g/mol
Physical formSolid
HS code29339900
Purity97%
InChIKeyNMHVTLJFPDOJOD-UHFFFAOYSA-N
IUPAC nametert-butyl 2-[4,7-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate

About Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%

Zemixal supplies Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97% within its laboratory Chemicals & Reagents portfolio. Key data (Puriss): CAS 122555-91-3, formula C26H50N4O6 and molar mass 514.7 g/mol. It is described as white to off-white solid.

Use cases we see most often

  • Titration end-point detection
  • pH determination
  • Analytical testing
  • Pharmaceutical synthesis

Safe handling

Classified under GHS with signal word Warning and hazard statements H315, H319 and H335. Read the SDS before first use.

Standard pack sizes are 100 mg, 250 mg, 1 g and 5 g, and custom quantities are quoted on request. Each lot travels with a batch certificate of analysis and a 16-section SDS. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.

Typical uses

  • Titration end-point detection
  • pH determination
  • Analytical testing
  • Pharmaceutical synthesis

Applications

Diagnostics, Life Science and BiotechResearch Labs and Universities

Specifications and identifiers

Specifications of Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%
Product nameTri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%
Catalogue numberZX-000420
CAS number122555-91-3
IUPAC nametert-butyl 2-[4,7-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate
Molecular formulaC26H50N4O6
Molar mass514.7 g/mol
Exact mass514.373
GradePuriss
Purity / assay97%
Physical formSolid
AppearanceWhite to off-white solid
XLogP32.4
H-bond donors / acceptors1 / 10
Topological polar surface area101 Ų
HS code29339900
InChIKeyNMHVTLJFPDOJOD-UHFFFAOYSA-N
SMILESCC(C)(C)OC(=O)CN1CCNCCN(CCN(CC1)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C
PubChem CID11237632
SynonymsDO3A-t-Bu-ester, Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, DO3A tert-Butyl ester, 1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic acid, 1,4,7-tris(1,1-dimethylethyl) ester, Tri-tert-butyl 2,2',2''-(1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetate, tert-Butyl 2-[4,7-bis(2-tert-butoxy-2-oxo-ethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate, 1,4,7,10-Tetraazacyclododecane-1,4,7-triacetic Acid Tri-tert-butyl Ester, DO3Atert-Butylester, 1,4,7-tris(t-butoxycarbonylmethyl)-1,4,7,10-tetraazacyclododecane, 1,4,7,10-Tetraazacyclododecane-4,7,10-triacetic acid tri-t-butyl ester, 1,4,7,10-Tetraazacyclododecane-4,7,10-triacetic acid tri-t-butyl-ester

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS07 Irritant or harmful
Irritant or harmful

Signal word Warning

  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements P261, P264, P264 + P265, P271, P280, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%
100 mgQuoted on request
250 mgQuoted on request
1 gQuoted on request
5 gQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%

Which CAS number identifies Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%?
Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97% is registered under CAS 122555-91-3. You may also see it listed as DO3A-t-Bu-ester, Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, DO3A tert-Butyl ester. Our catalogue number for this item is ZX-000420.
What are the formula and molar mass of Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%?
For Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%, its formula is C26H50N4O6 and its molar mass is 514.7 g/mol. The systematic (IUPAC) name is tert-butyl 2-[4,7-bis[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate. InChIKey NMHVTLJFPDOJOD-UHFFFAOYSA-N lets you match it in any structure database.
What grade and pack sizes are available for Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%?
This listing is Puriss grade with 97% purity. Standard packs are 100 mg, 250 mg, 1 g, 5 g. Larger quantities and custom packing can be quoted on request.
Which documents come with Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97%?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97% to my country?
Yes. Because Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7-triacetate, 97% is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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