TL;DR: 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro- (CAS 13772-78-6) is a chemical compound with molecular formula C10F8O and molecular weight 287.98215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,4,4,5,6,7,8-octafluoronaphthalen-1-one
Also Known As: 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro-, 2,3,4,4,5,6,7,8-octafluoronaphthalen-1-one, 2,3,4,4,5,6,7,8-Octafluoronaphthalen-1(4H)-one
| Molecular Formula | C10F8O |
| Molecular Weight | 287.98215 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.98215 Da |
| Heavy Atoms | 19 |
| Complexity | 447.0 |
| SMILES | C12=C(C(=C(C(=C1F)F)F)F)C(C(=C(C2=O)F)F)(F)F |
| InChIKey | RMNMUPYNFDPLGC-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro-. With a topological polar surface area (TPSA) of 17.1 Ų, 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro- has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro- is 13772-78-6.
The molecular formula of 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro- is C10F8O.
The molecular weight of 1(4H)-Naphthalenone, 2,3,4,4,5,6,7,8-octafluoro- is 287.98215 g/mol.
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