1,4,7-Trimethyl-1,4,7-triazacyclononane (stabilized with NaHCO3)

Product Information

Molecular Formula:
C9H21N3
Molecular Weight:
171.29
Description
1,4,7-Trimethyl-1,4,7-triazacyclononane (stabilized with NaHCO3) is an organic compound utilized primarily as a chelating agent. It is best known for its use in the research and development of radiopharmaceuticals, primarily helping to stabilize technetium and gallium isotopes for disease diagnostic development.
Synonyms
1,4,7-Trimethyl-1,4,7-triazonane; 1,4,7-Trimethyl-1,4,7-triazacyclononane; TMTAN; 1H-1,4,7-Triazonine, octahydro-1,4,7-trimethyl-; R7BZK76RTP; Octahydro-1,4,7-trimethyl-1H-1,4,7-triazonine; n,n',n''-trimethyl-1,4,7-triazacyclononane; tmtacn; 1,4,7-Trimethyl-1,4,7-triazacyclononane (stabilized with NaHCO3); 1,4,7-Trimethyl-1,4,7-triazacyclononane, 97%; 1,4,7-Trimethyl-1,4,7-triazacyclononane, (stabilized with NaHCO3)
IUPAC Name
1,4,7-trimethyl-1,4,7-triazonane
Canonical SMILES
CN1CCN(CCN(CC1)C)C
InChI
InChI=1S/C9H21N3/c1-10-4-6-11(2)8-9-12(3)7-5-10/h4-9H2,1-3H3
InChI Key
WLDGDTPNAKWAIR-UHFFFAOYSA-N
Flash Point
68 °C
Purity
>98.0%(GC)(T)
Density
0.90
Appearance
Colorless to Light orange to Yellow clear liquid
Storage
0-10°C
Refractive Index
1.47

Safety Information

Hazards
H314 H227
Precautionary Statement
P501 P210 P264 P280 P370 + P378 P303 + P361 + P353 P301 + P330 + P331 P363 P304 + P340 + P310 P305 + P351 + P338 + P310 P403 + P235 P405

Computed Properties

XLogP3
-0.4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
0
Exact Mass
171.173547683 g/mol
Monoisotopic Mass
171.173547683 g/mol
Topological Polar Surface Area
9.7Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
91.2
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
DK-202100368-A1 Cleaning compositions and uses thereof 2021-04-13
CN-215856365-U System device for realizing stable output of nitric oxide 2021-02-08
EP-3967742-A1 Compositions comprising bleaching catalyst, manufacturing process thereof, and bleaching and cleaning agent comprising same 2020-09-15
US-2022079862-A1 Hair care composition containing polymeric colorant 2020-09-14
US-2022079867-A1 Oxidative hair cream composition containing polymeric colorant 2020-09-14
US-2022079868-A1 Oxidative hair cream composition containing thiophene azo colorant 2020-09-14
WO-2022056203-A1 Oxidative hair cream composition containing polymeric colorant 2020-09-14
WO-2022056204-A1 Oxidative hair cream composition containing thiophene azo colorant 2020-09-14
WO-2022056205-A1 Hair care composition containing polymeric colorant 2020-09-14
WO-2022043547-A1 Protease variants with improved solubility 2020-08-28

Literatures

PMID Publication Date Title Journal
22990387 2012-11-14 A mononuclear ruthenium complex showing multiple proton-coupled electron transfer toward multi-electron transfer reactions Dalton transactions (Cambridge, England : 2003)
21970696 2011-11-23 Manganese triazacyclononane oxidation catalysts grafted under reaction conditions on solid cocatalytic supports Journal of the American Chemical Society
21830833 2011-09-05 Syntheses, structures, and magnetic properties of low-dimensional heterometallic complexes based on the versatile building block [(Tp)Cr(CN)3]- Inorganic chemistry
20735148 2010-09-17 Structure and dynamics of α-aryl amide and ketone enolates: THF, PMDTA, TMTAN, HMPA, and crypt-solvated lithium enolates, and comparison with phosphazenium analogues The Journal of organic chemistry
20627402 2010-09-01 Hydrolytic cleavage of double-strand DNA by the water-soluble dicobalt(III) complexes of 1,4,7-triazacyclononane-N-acetate Journal of inorganic biochemistry
20218652 2010-04-05 Eicosanuclear cluster [Cu(13)W(7)] of copper-octacyanotungstate bimetallic assembly: synthesis, structure, and magnetic properties Inorganic chemistry
20067236 2010-02-15 trans-[Os(III)(salen)(CN)(2)](-): a new paramagnetic building block for the construction of molecule-based magnetic materials Inorganic chemistry
20000374 2010-01-18 Metal-complexes as ligands to generate asymmetric homo- and heterodinuclear M(A)(III)M(B)(II) species: a magneto-structural and spectroscopic comparison of imidazole-N versus pyridine-N Inorganic chemistry
19663435 2009-09-16 X-ray emission spectroscopy to study ligand valence orbitals in Mn coordination complexes Journal of the American Chemical Society
19356599 2009-04-03 Aging accelerates the progression and manifestation of seizures in post-traumatic model of epilepsy Neuroscience letters
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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