TL;DR: Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- (CAS 125796-88-5) is a chemical compound with molecular formula C22H30O and molecular weight 310.22968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-ethylbutyl)-4-(4-phenylbutoxy)benzene
Also Known As: 1-(2-ethylbutyl)-4-(4-phenylbutoxy)benzene, Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)-
| Molecular Formula | C22H30O |
| Molecular Weight | 310.22968 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 310.22968 Da |
| Heavy Atoms | 23 |
| Complexity | 270.0 |
| SMILES | CCC(CC)CC1=CC=C(C=C1)OCCCCC2=CC=CC=C2 |
| InChIKey | LJTHOEKNSVPHNB-UHFFFAOYSA-N |
The XLogP value of 7.2 indicates that Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- is 125796-88-5.
The molecular formula of Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- is C22H30O.
The molecular weight of Benzene, 1-(2-ethylbutyl)-4-(4-phenylbutoxy)- is 310.22968 g/mol.
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