TL;DR: N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide (CAS 51814-65-4) is a chemical compound with molecular formula C12H10F7NO and molecular weight 317.06506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide
Also Known As: N-(2-ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide, N-(2-ethylphenyl)-2,2,3,3,4,4,4-heptafluoro-butanamide
| Molecular Formula | C12H10F7NO |
| Molecular Weight | 317.06506 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.06506 Da |
| Heavy Atoms | 21 |
| Complexity | 380.0 |
| SMILES | CCC1=CC=CC=C1NC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | WSXDNDBZYMSYLA-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide is 51814-65-4.
The molecular formula of N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide is C12H10F7NO.
The molecular weight of N-(2-Ethylphenyl)-2,2,3,3,4,4,4-heptafluorobutanamide is 317.06506 g/mol.
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