TL;DR: 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene (CAS 156868-93-8) is a chemical compound with molecular formula C12H14F2 and molecular weight 196.10635 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene
Also Known As: 5,7-Difluoro-1,1-dimethyltetralin, 5,7-difluoro-1,2,3,4-tetrahydro-1,1-dimethylnaphthalene, 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene, 5,7-difluoro-1,1-dimethyl-1,2,3,4-tetrahydronaphthalene
| Molecular Formula | C12H14F2 |
| Molecular Weight | 196.10635 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.10635 Da |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
| SMILES | CC1(CCCC2=C1C=C(C=C2F)F)C |
| InChIKey | NBAFASLLENWSII-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene is 156868-93-8.
The molecular formula of 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene is C12H14F2.
The molecular weight of 6,8-difluoro-4,4-dimethyl-2,3-dihydro-1H-naphthalene is 196.10635 g/mol.
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