TL;DR: 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate (CAS 114557-68-5) is a chemical compound with molecular formula C10H10BBrF4N2 and molecular weight 324.00565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate
Also Known As: 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate, 1-Naphthalenediazonium, 4-bromo-5,6,7,8-tetrahydro-, tetrafluoroborate(1-), 4-bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium,tetrafluoroborate, 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoridoborate(1-), IUPAC: 4-bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium; Tetrafluoroboron
| Molecular Formula | C10H10BBrF4N2 |
| Molecular Weight | 324.00565 g/mol |
| XLogP | 5.11248 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 324.00565 Da |
| Heavy Atoms | 18 |
| Complexity | 251.0 |
| SMILES | [B-](F)(F)(F)F.C1CCC2=C(C=CC(=C2C1)[N+]#N)Br |
| InChIKey | MVXUCPPWAAOJBY-UHFFFAOYSA-N |
The XLogP value of 5.11248 indicates that 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate is 114557-68-5.
The molecular formula of 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate is C10H10BBrF4N2.
The molecular weight of 4-Bromo-5,6,7,8-tetrahydronaphthalene-1-diazonium tetrafluoroborate is 324.00565 g/mol.
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