Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-
TL;DR: Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- (CAS 144395-91-5) is a chemical compound with molecular formula C8H16ClNO and molecular weight 177.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-3-(2-chloropropan-2-yl)oxaziridine
Also Known As: 2-tert-butyl-3-(2-chloropropan-2-yl)oxaziridine, Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-, RefChem:367172
| Molecular Formula | C8H16ClNO |
|---|---|
| Molecular Weight | 177.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 15.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.09204 |
| Heavy Atoms | 11 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 144395-91-5 |
|---|---|
| SMILES | CC(C)(C)N1C(O1)C(C)(C)Cl |
| InChIKey | XKYQWWVYRFMEOR-UHFFFAOYSA-N |
Product Overview
Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- (CAS 144395-91-5), with molecular formula C8H16ClNO and molecular weight 177.09 g/mol. IUPAC: 2-tert-butyl-3-(2-chloropropan-2-yl)oxaziridine.
Chemical Property Profile of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-
Property Insights of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-. With a topological polar surface area (TPSA) of 15.5 Ų, Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- 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 Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-?
The CAS number of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- is 144395-91-5.
What is the molecular formula of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-?
The molecular formula of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- is C8H16ClNO.
What is the molecular weight of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-?
The molecular weight of Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- is 177.09 g/mol.
Where can I buy Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-?
You can request a quote for Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Oxaziridine, 3-(1-chloro-1-methylethyl)-2-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.