TL;DR: 1-Chloro-3-(2-phenylethenyl)benzene (CAS 14064-43-8) is a chemical compound with molecular formula C14H11Cl and molecular weight 214.05493 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-3-(2-phenylethenyl)benzene
Also Known As: m-Cl-Stilben, Stilbene, 3-chloro-, 1-chloro-3-styrylbenzene, 1-chloro-3-(2-phenylethenyl)benzene, Benzene, 1-chloro-3-(2-phenylethenyl)-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H11Cl |
| Molecular Weight | 214.05493 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.05493 Da |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
| SMILES | C1=CC=C(C=C1)C=CC2=CC(=CC=C2)Cl |
| InChIKey | LLSLQJAZJCNYQW-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that 1-Chloro-3-(2-phenylethenyl)benzene 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-Chloro-3-(2-phenylethenyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3-(2-phenylethenyl)benzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-Chloro-3-(2-phenylethenyl)benzene is 14064-43-8.
The molecular formula of 1-Chloro-3-(2-phenylethenyl)benzene is C14H11Cl.
The molecular weight of 1-Chloro-3-(2-phenylethenyl)benzene is 214.05493 g/mol.
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