2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
TL;DR: 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane (CAS 1631-16-9) is a chemical compound with molecular formula C15H31N3 and molecular weight 253.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
Also Known As: 2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane, 2,4,6-TRI-TERT-BUTYL-1,3,5-TRIAZABICYCLO[3.1.0]HEXANE, 1,3,5-TRIAZABICYCLO[3.1.0]HEXANE,2,4,6-TRIS(1,1-DIMETHYLETHYL)-
| Molecular Formula | C15H31N3 |
|---|---|
| Molecular Weight | 253.25 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.2518 |
| Heavy Atoms | 18 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 1631-16-9 |
|---|---|
| SMILES | CC(C)(C)C1NC(N2N1C2C(C)(C)C)C(C)(C)C |
| InChIKey | LFOANSWPWFSECF-UHFFFAOYSA-N |
Product Overview
2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane (CAS 1631-16-9), with molecular formula C15H31N3 and molecular weight 253.25 g/mol. IUPAC: 2,4,6-tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane.
Chemical Property Profile of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
Property Insights of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane
The XLogP value of 5.3 indicates that 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.1 Ų, 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane?
The CAS number of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane is 1631-16-9.
What is the molecular formula of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane?
The molecular formula of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane is C15H31N3.
What is the molecular weight of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane?
The molecular weight of 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane is 253.25 g/mol.
Where can I buy 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane?
You can request a quote for 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tritert-butyl-1,3,5-triazabicyclo[3.1.0]hexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.