TL;DR: 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene (CAS 121043-48-9) is a chemical compound with molecular formula C16H16Cl2O and molecular weight 294.05783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-4-[(4-chlorophenyl)-propan-2-yloxymethyl]benzene
Also Known As: 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene, 1-chloro-4-[(4-chlorophenyl)-propan-2-yloxy-methyl]benzene, 1-chloro-4-[(4-chlorophenyl)-propan-2-yloxymethyl]benzene, 1,1'-{[(Propan-2-yl)oxy]methylene}bis(4-chlorobenzene)
| Molecular Formula | C16H16Cl2O |
| Molecular Weight | 294.05783 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.05783 Da |
| Heavy Atoms | 19 |
| Complexity | 231.0 |
| SMILES | CC(C)OC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl |
| InChIKey | SOFVYKVWGANHKY-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene is 121043-48-9.
The molecular formula of 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene is C16H16Cl2O.
The molecular weight of 1-Chloro-4-((4-chlorophenyl)-propan-2-yloxymethyl)benzene is 294.05783 g/mol.
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