3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one
TL;DR: 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one (CAS 50837-76-8) is a chemical compound with molecular formula C7H7F6NO and molecular weight 235.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,3-trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one
Also Known As: 3,3,3-trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one, Aziridine, 2-methyl-1-[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]-, 2-Methyl-1-[3,3,3-trifluoro-1-oxo-2- propyl]aziridine, 2-Methyl-1-[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]aziridine, 2-Methyl-1-[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl ]aziridine
| Molecular Formula | C7H7F6NO |
|---|---|
| Molecular Weight | 235.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 20.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.04318 |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 50837-76-8 |
|---|---|
| SMILES | CC1CN1C(=O)C(C(F)(F)F)C(F)(F)F |
| InChIKey | CQIVONYCAIRMJB-UHFFFAOYSA-N |
Product Overview
3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one (CAS 50837-76-8), with molecular formula C7H7F6NO and molecular weight 235.04 g/mol. IUPAC: 3,3,3-trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one.
Chemical Property Profile of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one
Property Insights of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one. With a topological polar surface area (TPSA) of 20.1 Ų, 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one 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 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one?
The CAS number of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one is 50837-76-8.
What is the molecular formula of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one?
The molecular formula of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one is C7H7F6NO.
What is the molecular weight of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one?
The molecular weight of 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one is 235.04 g/mol.
Where can I buy 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one?
You can request a quote for 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3,3,3-Trifluoro-1-(2-methylaziridin-1-yl)-2-(trifluoromethyl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.