TL;DR: 2-bromo-5-[(E)-2-bromoethenyl]furan (CAS 118316-48-6) is a chemical compound with molecular formula C6H4Br2O and molecular weight 249.86288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-5-[(E)-2-bromoethenyl]furan
Also Known As: Furan, 2-bromo-5-(2-bromoethenyl)-, 2-bromo-5-[(E)-2-bromoethenyl]furan
| Molecular Formula | C6H4Br2O |
| Molecular Weight | 249.86288 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.86288 Da |
| Heavy Atoms | 9 |
| Complexity | 114.0 |
| SMILES | C1=C(OC(=C1)Br)/C=C/Br |
| InChIKey | ULHPDZIKOMBZGT-ONEGZZNKSA-N |
The XLogP value of 3.3 indicates that 2-bromo-5-[(E)-2-bromoethenyl]furan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 2-bromo-5-[(E)-2-bromoethenyl]furan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromo-5-[(E)-2-bromoethenyl]furan has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-bromo-5-[(E)-2-bromoethenyl]furan is 118316-48-6.
The molecular formula of 2-bromo-5-[(E)-2-bromoethenyl]furan is C6H4Br2O.
The molecular weight of 2-bromo-5-[(E)-2-bromoethenyl]furan is 249.86288 g/mol.
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