1,4,7-Triazacyclononane
Product Information
Molecular Formula
C6H15N3
Molecular Weight
129.20
Description
1,4,7-Triazacyclononane (CAS# 4730-54-5) is a useful research chemical.
Synonyms
1,4,7-triazonane; 1,4,7-triazonane
IUPAC Name
1,4,7-triazonane
SMILES
C1CNCCNCCN1
InChI
InChI=1S/C6H15N3/c1-2-8-5-6-9-4-3-7-1/h7-9H,1-6H2
InChI Key
ITWBWJFEJCHKSN-UHFFFAOYSA-N
Boiling Point
113 °C / 7 mmHg
Melting Point
45 °C
Purity
> 98.0 % (GC)
Density
0.874 g/cm3
Appearance
White to almost white powder to crystal
LogP
-0.24480
Safety Information
Hazards
H314
Precautionary Statement
P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word
Danger
Computed Properties
XLogP3
-1.9
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
0
Exact Mass
129.126597491 g/mol
Monoisotopic Mass
129.126597491 g/mol
Topological Polar Surface Area
36.1Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
45.1
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 |
|---|---|---|
| CN-114062565-A | Method for detecting compound containing DOTA ring or NOTA ring in sample | 2022-01-14 |
| CN-114031837-A | Crosslinkable polyethylene insulating material for high-voltage cable, preparation method and application thereof | 2021-12-20 |
| CN-114116944-A | Trajectory prediction method and device based on time attention convolution network | 2021-11-30 |
| CN-114117259-A | Trajectory prediction method and device based on double attention mechanism | 2021-11-30 |
| CN-113980581-A | Environment-friendly suspending agent based on sapphire grinding, and preparation method and application thereof | 2021-11-29 |
| CN-114121795-A | Multi-threshold device manufacturing method and device structure | 2021-11-25 |
| CN-114028590-A | Granzyme B targeting complex, radiopharmaceutical, preparation methods and applications thereof | 2021-11-18 |
| CN-114014843-A | PSMA (patterned beam-selective membrane antigen) targeted nuclide/fluorescent bimodal ligand, molecular probe and application | 2021-11-17 |
| CN-114163499-A | Cadherin inhibitor and preparation method and application thereof | 2021-11-11 |
| CN-113831022-A | CsPbBr3:xDy3+Formula, preparation method and application of quantum dot glass | 2021-10-18 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 32869927 | 2020-12-01 | The molecular effect of 1,4,7-triazacyclononane on oxidative stress parameters in human hepatocellular carcinoma (HepG2) cells | Journal of biochemical and molecular toxicology |
| 23044866 | 2012-12-07 | Copper-64 labelling of triazacyclononane-triphosphinate chelators | Dalton transactions (Cambridge, England : 2003) |
| 22580919 | 2012-06-28 | New half sandwich Ru(II) coordination compounds for anticancer activity | Dalton transactions (Cambridge, England : 2003) |
| 22497506 | 2012-05-07 | In vivo imaging of folate receptor positive tumor xenografts using novel 68Ga-NODAGA-folate conjugates | Molecular pharmaceutics |
| 22416667 | 2012-04-02 | Combining bifunctional chelator with (3 + 2)-cycloaddition approaches: synthesis of dual-function technetium complexes | Inorganic chemistry |
| 21960257 | 2012-02-01 | Type 1 copper site synthetic model complexes with increased redox potentials | Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry |
| 22221199 | 2012-01-16 | Phosphodiester cleavage properties of copper(II) complexes of 1,4,7-triazacyclononane ligands bearing single alkyl guanidine pendants | Inorganic chemistry |
| 22221285 | 2012-01-02 | Complexation of metal ions with TRAP (1,4,7-triazacyclononane phosphinic acid) ligands and 1,4,7-triazacyclononane-1,4,7-triacetic acid: phosphinate-containing ligands as unique chelators for trivalent gallium | Inorganic chemistry |
| 22344885 | 2012-01-01 | Improving T₁ and T₂ magnetic resonance imaging contrast agents through the conjugation of an esteramide dendrimer to high-water-coordination Gd(III) hydroxypyridinone complexes | Contrast media & molecular imaging |
| 22085200 | 2011-12-19 | Electronic and molecular structures of the members of the electron transfer series [Cr(tbpy)3]n (n = 3+, 2+, 1+, 0): an X-ray absorption spectroscopic and density functional theoretical study | Inorganic chemistry |
