TL;DR: N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide (CAS 1022387-36-5) is a chemical compound with molecular formula C9H7F4NO2 and molecular weight 237.04129 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide
Also Known As: N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide, N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]carboxamide, Amino(3-(1,1,2,2-tetrafluoroethoxy)phenyl)carbaldehyde
| Molecular Formula | C9H7F4NO2 |
| Molecular Weight | 237.04129 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.04129 Da |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
| SMILES | C1=CC(=CC(=C1)OC(C(F)F)(F)F)NC=O |
| InChIKey | VNAACZFHBIRGFE-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide. With a topological polar surface area (TPSA) of 38.3 Ų, N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide is 1022387-36-5.
The molecular formula of N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide is C9H7F4NO2.
The molecular weight of N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]formamide is 237.04129 g/mol.
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