Gadolinium 5,8-bis(carboxylatomethyl)-11-[2-(methylamino)-2-oxoethyl]-3-oxo-2,5,8,11-tetraazatridecan-13-oate hydrate (1:1:1) | CAS No. 122795-43-1

Gadolinium 5,8-bis(carboxylatomethyl)-11-[2-(methylamino)-2-oxoethyl]-3-oxo-2,5,8,11-tetraazatridecan-13-oate hydrate (1:1:1)

Basic Information

CAS Number

122795-43-1

Molecular Formula

C16H28GdN5O9

Molecular Weight

591.7 g/mol

AD

Basic Physical Properties

Boiling Point

769.1°C at 760 mmHg

CNC(=O)CN(CCN(CCN(CC(=O)NC)CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O.[Gd+3]

InChI

InChI=1S/C16H29N5O8.Gd.H2O/c1-17-12(22)7-20(10-15(26)27)5-3-19(9-14(24)25)4-6-21(11-16(28)29)8-13(23)18-2;;/h3-11H2,1-2H3,(H,17,22)(H,18,23)(H,24,25)(H,26,27)(H,28,29);;1H2/q;+3;/p-3

InChIKey

XPCLDSMKWNNKOM-UHFFFAOYSA-K

LogP

-3.06190

Complexity

527

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

  • DTXCID6028573
  • BCP28893
  • Gadodiamide hydrate
  • D01645
  • 122795-43-1
  • NCGC00182547-01
  • Gadodiamide hydrate (JAN)
  • AB01568258_01
  • A921896
  • NCGC00184996-01
  • CAS-122795-43-1
  • s1751
  • Tox21_113000_1
  • Omniscan (TN)
  • Q2031078
  • 2-[bis[2-[carboxylatomethyl-[2-(methylamino)-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+);hydrate
  • NCGC00182547-02
  • Tox21_112999
  • SCHEMBL3175139
  • Tox21_113000
  • DTXSID9048647
  • Omniscan
  • CCG-270164
  • Gadolinium 5,8-bis(carboxylatomethyl)-2-[2-(methylamino)-2-oxoethyl]-10-oxo-2,5,8,11-tetraazadodecane-1-carboxylate hydrate
  • gadodiamide
  • NS00076465
  • AKOS015967052
  • Gadodiamide
  • 2-[bis[2-[carboxylatomethyl-[2-(methylamino)-2-oxoethyl]amino]ethyl]amino]acetate,gadolinium(3+),hydrate
  • Gadodiamide (hydrate)
  • GadodiaMide(OMniscan)

MDL Number

MFCD12912458

FAQ

What regulatory guidelines apply to Gadolinium 5,8-bis(carboxylatomethyl)-11-[2-(methylamino)-2-oxoethyl]-3-oxo-2,5,8,11-tetraazatridecan-13-oate hydrate (1:1:1) (CAS: 122795-43-1)?

This compound must comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations for European manufacturers and importers, and FDA/EPA guidelines for its use in medical imaging. Specific regulations may include hazard communication, storage, and disposal requirements.

Are there alternatives to Gadolinium 5,8-bis(carboxylatomethyl)-11-[2-(methylamino)-2-oxoethyl]-3-oxo-2,5,8,11-tetraazatridecan-13-oate hydrate (1:1:1) (CAS: 122795-43-1) in synthesis?

Alternatives include other chelating agents like ethylenediaminetetraacetic acid (EDTA) or diethylenetriaminepentaacetic acid (DTPA). However, these may have different stabilities or binding affinities, and may not be as effective in certain applications.

What is the market or research trend for Gadolinium 5,8-bis(carboxylatomethyl)-11-[2-(methylamino)-2-oxoethyl]-3-oxo-2,5,8,11-tetraazatridecan-13-oate hydrate (1:1:1) (CAS: 122795-43-1)?

Research trends focus on its use in medical imaging due to its gadolinium content. Market trends indicate a steady demand, driven by the need for contrast agents in MRI. Emerging research explores its use in targeted drug delivery systems and as a potential diagnostic tool in neurology.

How should waste containing Gadolinium 5,8-bis(carboxylatomethyl)-11-[2-(methylamino)-2-oxoethyl]-3-oxo-2,5,8,11-tetraazatridecan-13-oate hydrate (1:1:1) (CAS: 122795-43-1) be handled?

This waste should be collected in appropriate containers, labeled as hazardous, and disposed of through a professional waste management service. Incineration or chemical treatment may be necessary for complete breakdown before disposal. Environmental protection and safety measures must be strictly followed to prevent contamination.

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