1-Benzyl-3-tert-butyl-2,2-dimethylazetidine
TL;DR: 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine (CAS 22606-89-9) is a chemical compound with molecular formula C16H25N and molecular weight 231.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-tert-butyl-2,2-dimethylazetidine
Also Known As: 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine, Azetidine, 1-benzyl-3-tert-butyl-2,2-dimethyl-, 1-benzyl-3-(tert-butyl)-2,2-dimethylazetidine, 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine #, RefChem:228036
| Molecular Formula | C16H25N |
|---|---|
| Molecular Weight | 231.20 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.1987 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 22606-89-9 |
|---|---|
| SMILES | CC1(C(CN1CC2=CC=CC=C2)C(C)(C)C)C |
| InChIKey | FMCVPLJPSGGKLH-UHFFFAOYSA-N |
Product Overview
1-Benzyl-3-tert-butyl-2,2-dimethylazetidine (CAS 22606-89-9), with molecular formula C16H25N and molecular weight 231.20 g/mol. IUPAC: 1-benzyl-3-tert-butyl-2,2-dimethylazetidine.
Chemical Property Profile of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine
Property Insights of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine
The XLogP value of 4.1 indicates that 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine has 0 hydrogen bond donor(s) and 1 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-Benzyl-3-tert-butyl-2,2-dimethylazetidine?
The CAS number of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine is 22606-89-9.
What is the molecular formula of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine?
The molecular formula of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine is C16H25N.
What is the molecular weight of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine?
The molecular weight of 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine is 231.20 g/mol.
Where can I buy 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine?
You can request a quote for 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-tert-butyl-2,2-dimethylazetidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.