TL;DR: Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- (CAS 151265-24-6) is a chemical compound with molecular formula C12H12Br2 and molecular weight 313.93057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,6-dibromo-1-phenylbicyclo[3.1.0]hexane
Also Known As: 6,6-Dibromo-1-phenylbicyclo[3.1.0]hexane, Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl-, 1-Phenyl-6,6-dibromobicyclo[3.1.0]hexane, 6,6-dibromo-5-phenylbicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl bicyclo[3.1.0]hexane
| Molecular Formula | C12H12Br2 |
| Molecular Weight | 313.93057 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.93057 Da |
| Heavy Atoms | 14 |
| Complexity | 243.0 |
| SMILES | C1CC2C(C1)(C2(Br)Br)C3=CC=CC=C3 |
| InChIKey | PTTFLXLJFPETSM-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- is 151265-24-6.
The molecular formula of Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- is C12H12Br2.
The molecular weight of Bicyclo[3.1.0]hexane, 6,6-dibromo-1-phenyl- is 313.93057 g/mol.
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