1,4,7-Triazacyclononane - CAS 4730-54-5
Catalog: |
BB026254 |
Product Name: |
1,4,7-Triazacyclononane |
CAS: |
4730-54-5 |
Synonyms: |
1,4,7-triazonane; 1,4,7-triazonane |
IUPAC Name: | 1,4,7-triazonane |
Description: | 1,4,7-Triazacyclononane (CAS# 4730-54-5) is a useful research chemical. |
Molecular Weight: | 129.20 |
Molecular Formula: | C6H15N3 |
Canonical 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 |
MDL: | MFCD00012358 |
LogP: | -0.24480 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
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 |
Publication Number | Title | Priority Date |
CN-113512196-A | Alcohol solution of alkyl silanol and preparation method | 20210719 |
CN-113374069-A | Light heat-preservation ceiling board replacing fresh air pipe and gypsum board | 20210618 |
CN-113372245-A | Synthesis method of N-benzoyl-O, O-p-toluenesulfonyl-diethanolamine | 20210617 |
CN-113321624-A | Synthesis method of 1,4, 7-triazacyclononane | 20210615 |
CN-113517352-A | Manufacturing method of semi-floating gate device | 20210601 |
PMID | Publication Date | Title | Journal |
32869927 | 20201201 | The molecular effect of 1,4,7-triazacyclononane on oxidative stress parameters in human hepatocellular carcinoma (HepG2) cells | Journal of biochemical and molecular toxicology |
25146125 | 20141001 | N-terminal modifications improve the receptor affinity and pharmacokinetics of radiolabeled peptidic gastrin-releasing peptide receptor antagonists: examples of 68Ga- and 64Cu-labeled peptides for PET imaging | Journal of nuclear medicine : official publication, Society of Nuclear Medicine |
23044866 | 20121207 | Copper-64 labelling of triazacyclononane-triphosphinate chelators | Dalton transactions (Cambridge, England : 2003) |
22820520 | 20120907 | Uranium-mediated reductive conversion of CO2 to CO and carbonate in a single-vessel, closed synthetic cycle | Chemical communications (Cambridge, England) |
22580919 | 20120628 | New half sandwich Ru(II) coordination compounds for anticancer activity | Dalton transactions (Cambridge, England : 2003) |
Complexity: | 45.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 129.126597491 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 129.126597491 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 36.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.9 |
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