1,4,7-Trimethyl-1,4,7-triazacyclononane
TL;DR: 1,4,7-Trimethyl-1,4,7-triazacyclononane (CAS 96556-05-7) is a chemical compound with molecular formula C9H21N3 and molecular weight 171.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,7-trimethyl-1,4,7-triazonane
Also Known As: 1,4,7-Trimethyl-1,4,7-triazonane, 1,4,7-Trimethyl-1,4,7-triazacyclononane, tmtacn, TMTAN, Me3TACN
| Molecular Formula | C9H21N3 |
|---|---|
| Molecular Weight | 171.17 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 9.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 171.17355 |
| Heavy Atoms | 12 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 96556-05-7 |
|---|---|
| SMILES | CN1CCN(CCN(CC1)C)C |
| InChIKey | WLDGDTPNAKWAIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,7-Trimethyl-1,4,7-triazacyclononane (CAS 96556-05-7), with molecular formula C9H21N3 and molecular weight 171.17 g/mol. IUPAC: 1,4,7-trimethyl-1,4,7-triazonane.
Chemical Property Profile of 1,4,7-Trimethyl-1,4,7-triazacyclononane
Property Insights of 1,4,7-Trimethyl-1,4,7-triazacyclononane
The XLogP value of -0.4 indicates that 1,4,7-Trimethyl-1,4,7-triazacyclononane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.7 Ų, 1,4,7-Trimethyl-1,4,7-triazacyclononane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,7-Trimethyl-1,4,7-triazacyclononane has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4,7-Trimethyl-1,4,7-triazacyclononane?
The CAS number of 1,4,7-Trimethyl-1,4,7-triazacyclononane is 96556-05-7.
What is the molecular formula of 1,4,7-Trimethyl-1,4,7-triazacyclononane?
The molecular formula of 1,4,7-Trimethyl-1,4,7-triazacyclononane is C9H21N3.
What is the molecular weight of 1,4,7-Trimethyl-1,4,7-triazacyclononane?
The molecular weight of 1,4,7-Trimethyl-1,4,7-triazacyclononane is 171.17 g/mol.
Where can I buy 1,4,7-Trimethyl-1,4,7-triazacyclononane?
You can request a quote for 1,4,7-Trimethyl-1,4,7-triazacyclononane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,7-Trimethyl-1,4,7-triazacyclononane?
Yes, KEHONG BIO provides custom synthesis services for 1,4,7-Trimethyl-1,4,7-triazacyclononane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.