TL;DR: 1-Ethyl-4-[2-(4-propylphenyl)ethynyl]benzene (CAS 102225-55-8) is a chemical compound with molecular formula C19H20 and molecular weight 248.1565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethyl-4-[2-(4-propylphenyl)ethynyl]benzene
Also Known As: 1-Aminopyrene, 1-Ethyl-4-[(4-n-propylphenyl)ethynyl]benzene, (4-ethylphenyl)-(4'-n-propylphenyl)ethyne, 1-ethyl-4-[2-(4-propylphenyl)ethynyl]benzene, 1-Ethyl-4-[(4-propylphenyl)ethynyl]benzene
| Molecular Formula | C19H20 |
| Molecular Weight | 248.1565 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.1565 Da |
| Heavy Atoms | 19 |
| Complexity | 299.0 |
| SMILES | CCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)CC |
| InChIKey | SAVOJCMTUWNCLL-UHFFFAOYSA-N |
The XLogP value of 6.1 indicates that 1-Ethyl-4-[2-(4-propylphenyl)ethynyl]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-Ethyl-4-[2-(4-propylphenyl)ethynyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-4-[2-(4-propylphenyl)ethynyl]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-Ethyl-4-[2-(4-propylphenyl)ethynyl]benzene is 102225-55-8.
The molecular formula of 1-Ethyl-4-[2-(4-propylphenyl)ethynyl]benzene is C19H20.
The molecular weight of 1-Ethyl-4-[2-(4-propylphenyl)ethynyl]benzene is 248.1565 g/mol.
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