2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine
TL;DR: 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine (CAS 144396-00-9) is a chemical compound with molecular formula C6H10Cl3NO and molecular weight 216.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-3-(trichloromethyl)oxaziridine
Also Known As: 2-t-Butyl-3-(trichloromethyl)oxaziridine, 2-tert-butyl-3-(trichloromethyl)oxaziridine, 2-tert-butyl-3-(trichloromethyl)-1,2-oxaziridine, 2-tert-butyl-3-(trichloromethyl)-[1,2]oxaziridine
| Molecular Formula | C6H10Cl3NO |
|---|---|
| Molecular Weight | 216.98 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 15.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.9828 |
| Heavy Atoms | 11 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 144396-00-9 |
|---|---|
| SMILES | CC(C)(C)N1C(O1)C(Cl)(Cl)Cl |
| InChIKey | URRVKQHINCACCQ-UHFFFAOYSA-N |
Product Overview
2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine (CAS 144396-00-9), with molecular formula C6H10Cl3NO and molecular weight 216.98 g/mol. IUPAC: 2-tert-butyl-3-(trichloromethyl)oxaziridine.
Chemical Property Profile of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine
Property Insights of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine
The XLogP value of 3.1 indicates that 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.5 Ų, 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine has 0 hydrogen bond donor(s) and 2 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 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine?
The CAS number of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine is 144396-00-9.
What is the molecular formula of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine?
The molecular formula of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine is C6H10Cl3NO.
What is the molecular weight of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine?
The molecular weight of 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine is 216.98 g/mol.
Where can I buy 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine?
You can request a quote for 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Tert-butyl-3-(trichloromethyl)-1,2-oxaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.