Cas no 58966-93-1 (1,4,7-Triazacyclononane trihydrochloride)

1,4,7-Triazacyclononane trihydrochloride is a cyclic triamine compound widely utilized as a versatile chelating agent in coordination chemistry. Its rigid macrocyclic structure enables strong binding to transition metals, making it valuable for applications in catalysis, radiopharmaceuticals, and molecular imaging. The trihydrochloride salt form enhances solubility in aqueous and polar solvents, facilitating its use in biological and synthetic systems. The compound’s high selectivity for metal ions, particularly lanthanides and actinides, is advantageous for metal separation and labeling studies. Its stability and well-defined coordination geometry also support its role in designing metal-based therapeutics and contrast agents. This reagent is commonly employed in research involving supramolecular chemistry and material science.
1,4,7-Triazacyclononane trihydrochloride structure
58966-93-1 structure
Product Name:1,4,7-Triazacyclononane trihydrochloride
CAS No:58966-93-1
MF:C6H18Cl3N3
MW:238.586218357086
MDL:MFCD00074887
CID:370323
PubChem ID:24859794
Update Time:2025-06-07

1,4,7-Triazacyclononane trihydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1,4,7-Triazonane trihydrochloride
    • 1,4,7-Triazacyclononane Trihydrochloride
    • 1H-1,4,7-Triazonine,octahydro-, hydrochloride (1:3)
    • Octahydro-1H-1,4,7-triazonine Trihydrochloride
    • Octahydro-1H-1,4,7-triazonine hydrochloride
    • 1,4,7-Triazacyclononane Tri hydrochloride
    • 1H-1,4,7-Triazonine, octahydro-, trihydrochloride
    • PubChem21332
    • 1,4,7-TRIAZACYCLONONANETRIHYDROCHLORIDE
    • C6H15N3.3HCl
    • KSC911S7J
    • HNPMVNQYFPWBKI-UHFFFAOYSA-N
    • BCP10134
    • RW2688
    • AK111053
    • AB0031575
    • AX8209990
    • X47
    • MFCD00074887
    • AS-19124
    • 1,4,7-TRIAZACYCLONONANE 3HCL
    • B2699-153380
    • A827180
    • CS-0105719
    • 1,4,7-Triazacyclononane trihydrochloride, 97%
    • AKOS015845403
    • C6H18Cl3N3
    • AMY38506
    • 58966-93-1
    • 1,4,7-triazonaneTrihydrochloride
    • T1600
    • 1,4,7-Triazonane triHCl
    • F19546
    • 1,4,7-triazonane;trihydrochloride
    • (4-BUTYL-BENZYL)-HYDRAZINE
    • DTXSID30369319
    • 1,4,7-Triazacyclononane trihydrochloride
    • MDL: MFCD00074887
    • 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
    • SMILES: Cl.Cl.Cl.N1CCNCCNCC1

Computed Properties

  • Exact Mass: 237.05700
  • Monoisotopic Mass: 237.057
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 45.1
  • Covalently-Bonded Unit Count: 4
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 36.1

Experimental Properties

  • Color/Form: Not determined
  • Melting Point: 288?°C (dec.) (lit.)
  • Boiling Point: 254.1 °C at 760 mmHg
  • Flash Point: 87.2 °C
  • PSA: 36.09000
  • LogP: 2.16120

1,4,7-Triazacyclononane trihydrochloride Security Information

  • Symbol: GHS05
  • Prompt:dangerous
  • Signal Word:Danger
  • Hazard Statement: H314
  • Warning Statement: P280-P305+P351+P338-P310
  • Hazardous Material transportation number:UN 3261 8/PG 2
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: S26; S36/37/39; S45
  • FLUKA BRAND F CODES:3-9
  • Hazardous Material Identification: C
  • HazardClass:8
  • PackingGroup:III
  • Storage Condition:Store at room temperature
  • Risk Phrases:R34
  • Packing Group:III

1,4,7-Triazacyclononane trihydrochloride Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1,4,7-Triazacyclononane trihydrochloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd.
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Chemenu
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Alichem
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1,4,7-Triazacyclononane trihydrochloride Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:58966-93-1)1,4,7-Triazonanetrihydrochloride
Order Number:LE015
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 11:36
Price ($):discuss personally

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Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:58966-93-1)1,4,7-Triazonanetrihydrochloride
LE015
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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