329495

1,4,7-Triazacyclononane trihydrochloride

97%

• Empirical Formula (Hill Notation): C₆H₁₅N₃ · 3HCl
• CAS Number: 58966-93-1
• Molecular Weight: 238.59
• Beilstein/REAXYS Number: 5287631
• MDL number: MFCD00074887
• UNSPSC Code: 12352005
• PubChem Substance ID: 24859794
• NACRES: NA.22

Properties

• assay: 97%
• form: solid
• mp: 288 °C (dec.) (lit.)
• SMILES string: Cl[H].Cl[H].Cl[H].C1CNCCNCCN1
• InChI: 1S/C6H15N3.3ClH/c1-2-8-5-6-9-4-3-7-1;;;/h7-9H,1-6H2;3*1H
• InChI key: HNPMVNQYFPWBKI-UHFFFAOYSA-N

Description

Application

1,4,7-Triazacyclononane trihydrochloride can be used as a reagent to prepare:

• Nonadentate ligand, 1,4,7-tris[(6-carboxypyridin-2-yl)methyl]-1,4,7-triazacyclononane (H3tpatcn), which is used to prepare lanthanide complexes with high water solubility and rigid C₃ symmetric structures.
• Dansyl cryptands as fluorescent indicators via amination of (bromobenzyl)triazacycloalkane and oxadiamines.
• [1,4,7-tri(3-butenyl)-1,4,7-triazacyclononane and 1,4,7-tri(2-propenyl)-1,4,7-triazacyclononane] by reacting with corresponding alkenyl halide.

Possible reagent for compleximetric titrations with high cation-binding selectivity.

Safety Information

• pictograms: GHS05
• signalword: Danger
• hcodes: H314
• pcodes: P260 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363
• Hazard Classifications: Eye Dam. 1 - Skin Corr. 1B
• Storage Class: 8A - Combustible corrosive hazardous materials
• wgk_germany: WGK 3
• ppe: Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges