TL;DR: 2,3,6,7-Tetrabromonaphthalene (CAS 69881-92-1) is a chemical compound with molecular formula C10H4Br4 and molecular weight 439.70465 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,6,7-tetrabromonaphthalene
Also Known As: 2,3,6,7-Tetrabromonaphthalene, Naphthalene,2,3,6,7-tetrabromo-, NAPHTHALENE, 2,3,6,7-TETRABROMO-, J1.812.497A
| Molecular Formula | C10H4Br4 |
| Molecular Weight | 439.70465 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 443.70056 Da |
| Heavy Atoms | 14 |
| Complexity | 166.0 |
| SMILES | C1=C2C=C(C(=CC2=CC(=C1Br)Br)Br)Br |
| InChIKey | ZWEYMNHQUMTRGY-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that 2,3,6,7-Tetrabromonaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3,6,7-Tetrabromonaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,6,7-Tetrabromonaphthalene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2,3,6,7-Tetrabromonaphthalene is 69881-92-1.
The molecular formula of 2,3,6,7-Tetrabromonaphthalene is C10H4Br4.
The molecular weight of 2,3,6,7-Tetrabromonaphthalene is 439.70465 g/mol.
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