TL;DR: 1,2,4,6,7-Pentabromonaphthalene (CAS 75625-25-1) is a chemical compound with molecular formula C10H3Br5 and molecular weight 517.6152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4,6,7-pentabromonaphthalene
Also Known As: 1,2,4,6,7-Pentabromonaphthalene, NAPHTHALENE, 1,2,4,6,7-PENTABROMO-, J2.399.746K, L8NVW4FOP3
| Molecular Formula | C10H3Br5 |
| Molecular Weight | 517.6152 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 521.6111 Da |
| Heavy Atoms | 15 |
| Complexity | 234.0 |
| SMILES | C1=C2C(=CC(=C1Br)Br)C(=C(C=C2Br)Br)Br |
| InChIKey | BZPSOPFSQYNUQX-UHFFFAOYSA-N |
The XLogP value of 6.6 indicates that 1,2,4,6,7-Pentabromonaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,4,6,7-Pentabromonaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4,6,7-Pentabromonaphthalene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,2,4,6,7-Pentabromonaphthalene is 75625-25-1.
The molecular formula of 1,2,4,6,7-Pentabromonaphthalene is C10H3Br5.
The molecular weight of 1,2,4,6,7-Pentabromonaphthalene is 517.6152 g/mol.
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