![N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide structure](/static/products/1047/104712-16-5.webp)
N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide
TL;DR: N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide (CAS 104712-16-5) is a chemical compound with molecular formula C6H5F6NO and molecular weight 221.02753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)propanamide
Also Known As: N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide, N-(hexafluoropropan-2-ylidene)propanamide, N-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)propanamide, 6,6,6-trifluoro-5-(trifluoromethyl)-4-azahex-4-en-3-one
Technical Specifications
| Molecular Formula | C6H5F6NO |
| Molecular Weight | 221.02753 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.02753 Da |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
| SMILES | CCC(=O)N=C(C(F)(F)F)C(F)(F)F |
| InChIKey | PCLUXRLBJCEHEX-UHFFFAOYSA-N |
Chemical Property Profile of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide
Property Insights of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide. With a topological polar surface area (TPSA) of 29.4 Ų, N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide 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
What is the CAS number of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide?
The CAS number of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide is 104712-16-5.
What is the molecular formula of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide?
The molecular formula of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide is C6H5F6NO.
What is the molecular weight of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide?
The molecular weight of N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide is 221.02753 g/mol.
Where can I buy N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide?
You can request a quote for N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide?
Yes, CoreyChem provides custom synthesis services for N1-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.