Cas no 5807-14-7 (Triazabicyclodecene)

Triazabicyclodecene is a robust organic catalyst exhibiting high efficiency in promoting various chemical reactions, including those involving carbonyl compounds and imides. Its thermally stable nature and ability to withstand acidic conditions render it an attractive option for use in pharmaceutical synthesis and polymerization processes.
Triazabicyclodecene structure
Triazabicyclodecene structure
Product Name:Triazabicyclodecene
CAS No:5807-14-7
MF:C7H13N3
MW:139.198220968246
MDL:MFCD00043003
CID:376135
PubChem ID:79873
Update Time:2025-07-14

Triazabicyclodecene Chemical and Physical Properties

Names and Identifiers

    • 2,3,4,6,7,8-Hexahydro-1H-pyrimido[1,2-a]pyrimidine
    • 1,5,7-Triazabicyclo[4.4.0]dec-5-ene
    • 1,3,4,6,7,8-HEXAHYDRO-2H-PYRIMIDO[1,2-A]PYRIMIDINE
    • 1,5,7-TRIAZABICYCLO(4.4.0)DEC-5-ENE
    • 2H-Pyrimido[1,2-a]pyrimidine,1,3,4,6,7,8-hexahydro-
    • 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine
    • Hhpp
    • TBD
    • Triazabicyclodecene
    • EINECS 227-367-1
    • Q7840264
    • 5807-14-7
    • CS-B0736
    • 1,5,7-Triazabicyclo[4.4.0]dec-5-ene, purum, >=98.0% (T)
    • 2H-Pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro-
    • BCP09211
    • A930606
    • EN300-267515
    • CHEBI:94622
    • SY013446
    • HY-59156
    • J-509567
    • 1,3,4,6,7,8-Hexahydro-2H-pyrimido(1,2-a)pyrimidine
    • DS-15178
    • AKOS006222316
    • A831720
    • 1,5,7-triazabicyclo[4,4,0]dec-5-ene
    • 1,5,7-triazabicyclo[4.4.0]deca-5-ene
    • SCHEMBL51453
    • KAF7GN82TM
    • DTXSID10206793
    • NS00033853
    • 1,5,7-triazabicyclo[4,4,0] dec-5-ene
    • MFCD00043003
    • 1,5,7-Triazabicylo[4.4.0]dec-5-ene
    • UNII-KAF7GN82TM
    • T1982
    • 1,5,7-triazabicyclo [4.4.0]dec-5-ene
    • PD053640
    • 1H,2H,3H,4H,6H,7H,8H-[1,3]diazino[1,2-a]pyrimidine
    • BRD-K45542213-001-01-4
    • 1,5,7-Triazabicyclo[4.4.0]dec-5-ene, 98%
    • 1,3,4,6,7,8,-hexahydro-2H-pyrimido(1,2-a)pyrimidine
    • FT-0690905
    • PB43106
    • 2H-Pyrimido(1,2-a)pyrimidine, 1,3,4,6,7,8-hexahydro-
    • TBD; 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]pyrimidine; 1,5,7-Triazabicyclo[4.4.0]deca-5-ene; 1,5,9-Triazabicyclo[4.4.0]dec-9-ene; 2,3,4,6,7,8-Hexahydro-1H-pyrimido[1,2-a]pyrimidine;
    • 4H-Pyrimidino[1,2-a]pyrimidine, 2,3,6,7,8,9-hexahydro-
    • MDL: MFCD00043003
    • Inchi: 1S/C7H13N3/c1-3-8-7-9-4-2-6-10(7)5-1/h1-6H2,(H,8,9)
    • InChI Key: FVKFHMNJTHKMRX-UHFFFAOYSA-N
    • SMILES: N12C(=NCCC1)NCCC2

Computed Properties

  • Exact Mass: 139.11100
  • Monoisotopic Mass: 139.110947427g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 153
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 27.6?2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: -0.3

Experimental Properties

  • Color/Form: Not determined
  • Melting Point: 128.0 to 132.0 deg-C
  • Solubility: toluene: soluble1 g/15 mL
  • PSA: 27.63000
  • LogP: -0.25630
  • Solubility: Not determined

Triazabicyclodecene Security Information

Triazabicyclodecene Customs Data

  • HS CODE:2933599090
  • Customs Data:

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the structure. 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:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Triazabicyclodecene Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
T822422-100g
1,5,7-Triazabicyclo[4.4.0]dec-5-ene
5807-14-7 97%
100g
¥1,760.00 2022-10-10
XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
345571-5G
Triazabicyclodecene
5807-14-7
5g
¥1133.54 2023-12-07
ChemScence
CS-B0736-5g
1,5,7-Triazabicyclo[4.4.0]dec-5-ene
5807-14-7 99.51%
5g
$21.0 2022-04-27
ChemScence
CS-B0736-10g
1,5,7-Triazabicyclo[4.4.0]dec-5-ene
5807-14-7 99.51%
10g
$37.0 2022-04-27
ChemScence
CS-B0736-25g
1,5,7-Triazabicyclo[4.4.0]dec-5-ene
5807-14-7 99.51%
25g
$73.0 2022-04-27
ChemScence
CS-B0736-100g
1,5,7-Triazabicyclo[4.4.0]dec-5-ene
5807-14-7 99.51%
100g
$265.0 2022-04-27
ChemScence
CS-B0736-500g
1,5,7-Triazabicyclo[4.4.0]dec-5-ene
5807-14-7 99.51%
500g
$880.0 2022-04-27
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
T79660-5g
2,3,4,6,7,8-Hexahydro-1H-pyrimido[1,2-a]pyrimidine
5807-14-7 97%
5g
¥44.0 2024-07-18
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
T79660-1g
2,3,4,6,7,8-Hexahydro-1H-pyrimido[1,2-a]pyrimidine
5807-14-7 97%
1g
¥20.0 2024-07-18
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
T79660-100g
2,3,4,6,7,8-Hexahydro-1H-pyrimido[1,2-a]pyrimidine
5807-14-7 97%
100g
¥1419.0 2022-12-29

Triazabicyclodecene Production Method

Production Method 1

Reaction Conditions
1.1160°C
2.12 h, 200°C
Reference
Method for synthesizing bicyclic guanidine
By Cui, Zhaoshan et al, Faming Zhuanli Shenqing, From Faming Zhuanli Shenqing, 112094273, 18 Dec 2020, 112094273, 18 Dec 2020

Triazabicyclodecene Raw materials

Triazabicyclodecene Preparation Products

Triazabicyclodecene Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:5807-14-7)1,5,7-Triazabicyclo[4.4.0]dec-5-ene
Order Number:sfd10035
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:35
Price ($):discuss personally
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:5807-14-7)Triazabicyclodecene
Order Number:A930606
Stock Status:in Stock
Quantity:250.0g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 15:01
Price ($):206.0
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier Audited Supplier
(CAS:5807-14-7)1,5,7-Triazabicyclo [4.4.0] dec-5-ene
Order Number:JH059
Stock Status:in Stock
Quantity:25kg
Purity:98.00%
Pricing Information Last Updated:Monday, 8 January 2024 17:37
Price ($): negotiated

Triazabicyclodecene Spectrogram

GC-MS
GC-MS
1H NMR 300 MHz DMSO
1H NMR
13C NMR
13C NMR

Additional information on Triazabicyclodecene

Introduction to Triazabicyclodecene (CAS No. 5807-14-7)

Triazabicyclodecene, a compound with the chemical formula C10H9N3, is a highly intriguing molecule that has garnered significant attention in the field of chemical and pharmaceutical research. The compound is identified by its unique CAS number, CAS No. 5807-14-7, which distinguishes it in the vast repository of chemical substances. This introduction aims to provide a comprehensive overview of Triazabicyclodecene, delving into its structural characteristics, potential applications, and the latest research findings that underscore its significance.

The molecular structure of Triazabicyclodecene consists of a bicyclic framework fused with three nitrogen atoms, forming a triazole ring system. This structural motif imparts unique electronic and steric properties to the molecule, making it a versatile scaffold for various chemical modifications. The presence of multiple reactive sites allows for the synthesis of derivatives that can exhibit diverse biological activities. Such structural features have positioned Triazabicyclodecene as a subject of intense study in medicinal chemistry.

In recent years, the pharmaceutical industry has shown increasing interest in heterocyclic compounds due to their potential therapeutic benefits. Triazabicyclodecene, with its triazole core, has been explored as a key intermediate in the development of novel drugs targeting various diseases. Its ability to interact with biological targets at multiple levels makes it an attractive candidate for drug design. Researchers have been particularly keen on understanding how modifications to the triazole ring can enhance binding affinity and selectivity, thereby improving drug efficacy.

One of the most promising applications of Triazabicyclodecene lies in its role as a precursor for antiviral and anticancer agents. The compound's unique structure allows for the incorporation of pharmacophores that can disrupt viral replication or inhibit cancer cell proliferation. For instance, studies have demonstrated that certain derivatives of Triazabicyclodecene exhibit potent antiviral activity against RNA viruses by interfering with their replication cycle. Similarly, in oncology research, modifications to the molecule have led to the discovery of compounds that selectively target cancer cells without harming healthy tissues.

The synthesis of Triazabicyclodecene presents both challenges and opportunities for chemists. The construction of the bicyclic system while maintaining the integrity of the triazole ring requires precise synthetic strategies. Advances in organic synthesis have enabled more efficient routes to this compound, including catalytic methods that minimize byproduct formation. These improvements have not only made the production of Triazabicyclodecene more feasible but also more sustainable.

Recent research has also highlighted the importance of computational methods in understanding the behavior of Triazabicyclodecene and its derivatives. Molecular modeling techniques have been employed to predict how different structural modifications will affect biological activity. These simulations provide valuable insights into the molecular interactions that underpin drug efficacy, guiding experimental efforts toward more effective candidates.

The environmental impact of synthesizing and using Triazabicyclodecene is another area of growing interest. Efforts are underway to develop greener synthetic routes that reduce waste and energy consumption. Additionally, researchers are exploring ways to optimize the compound's biodegradability to minimize environmental persistence. Such initiatives align with broader trends in sustainable chemistry, where reducing the ecological footprint of chemical processes is paramount.

As our understanding of Triazabicyclodecene continues to evolve, so does its potential in addressing global health challenges. The compound's versatility as a scaffold for drug development makes it a cornerstone in modern medicinal chemistry. By leveraging cutting-edge synthetic methodologies and computational tools, scientists are paving the way for new treatments that could benefit millions worldwide.

In conclusion, Triazabicyclodecene (CAS No. 5807-14-7) represents a fascinating molecule with far-reaching implications in pharmaceutical research. Its unique structure and reactivity make it a valuable asset in developing novel therapeutics for infectious diseases and cancer. As research progresses, we can expect even more innovative applications to emerge from this versatile compound.

Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:5807-14-7)1,5,7-Triazabicyclo[4.4.0]dec-5-ene
sfd10035
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
Email
Amadis Chemical Company Limited
(CAS:5807-14-7)Triazabicyclodecene
A930606
Purity:99%
Quantity:250.0g
Price ($):206.0
Email