1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine
TL;DR: 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine (CAS 5632-64-4) is a chemical compound with molecular formula C10H7F6N and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine
Also Known As: 1-benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine, N-Benzyl-2,2,3-trifluor-2-trifluormethyl-aziridin, RefChem:227926
| Molecular Formula | C10H7F6N |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.04826 |
| Heavy Atoms | 17 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 5632-64-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(C2(F)F)(C(F)(F)F)F |
| InChIKey | BECHDMAEJZVKBX-UHFFFAOYSA-N |
Product Overview
1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine (CAS 5632-64-4), with molecular formula C10H7F6N and molecular weight 255.05 g/mol. IUPAC: 1-benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine.
Chemical Property Profile of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine
Property Insights of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine
The XLogP value of 3.7 indicates that 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.0 Ų, 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine has 0 hydrogen bond donor(s) and 7 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-2,2,3-trifluoro-3-(trifluoromethyl)aziridine?
The CAS number of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine is 5632-64-4.
What is the molecular formula of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine?
The molecular formula of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine is C10H7F6N.
What is the molecular weight of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine?
The molecular weight of 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine is 255.05 g/mol.
Where can I buy 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine?
You can request a quote for 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-2,2,3-trifluoro-3-(trifluoromethyl)aziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.