TL;DR: 2,4-Diphenyl-1-butene (CAS 16606-47-6) is a chemical compound with molecular formula C16H16 and molecular weight 208.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenylbut-3-enylbenzene
Also Known As: 2,4-Diphenyl-1-butene, 3-phenylbut-3-enylbenzene, alpha-Phenethylstyrene, 1-Butene, 2,4-diphenyl-, 1-phenethylvinylbenzene
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H16 |
| Molecular Weight | 208.1252 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.1252 Da |
| Heavy Atoms | 16 |
| Complexity | 204.0 |
| SMILES | C=C(CCC1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | PWSZACWUDDFZMQ-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that 2,4-Diphenyl-1-butene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,4-Diphenyl-1-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Diphenyl-1-butene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2,4-Diphenyl-1-butene is 16606-47-6.
The molecular formula of 2,4-Diphenyl-1-butene is C16H16.
The molecular weight of 2,4-Diphenyl-1-butene is 208.1252 g/mol.
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