TL;DR: Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- (CAS 114394-44-4) is a chemical compound with molecular formula C14H11Br and molecular weight 258.00443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(Z)-1-bromo-2-phenylethenyl]benzene
Also Known As: (Z)-alpha-Bromostilbene, alpha-Bromo-trans-stilbene, (Z)-1,2-Diphenyl-1-bromoethene, (Z)-1-Bromo-1,2-diphenylethene, [(Z)-1-Bromo-2-phenylethenyl]benzene
| Molecular Formula | C14H11Br |
| Molecular Weight | 258.00443 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.00443 Da |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
| SMILES | C1=CC=C(C=C1)/C=C(/C2=CC=CC=C2)\Br |
| InChIKey | WATOIJDGHUTRRF-KAMYIIQDSA-N |
The XLogP value of 4.7 indicates that Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- 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 Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- is 114394-44-4.
The molecular formula of Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- is C14H11Br.
The molecular weight of Benzene, 1,1'-(1-bromo-1,2-ethenediyl)bis- is 258.00443 g/mol.
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