TL;DR: 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene (CAS 128631-94-7) is a chemical compound with molecular formula C20H26O3 and molecular weight 314.1882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butan-2-yloxy-4-[(4-propan-2-yloxyphenyl)methoxy]benzene
Also Known As: 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene, 1-butan-2-yloxy-4-[(4-propan-2-yloxyphenyl)methoxy]benzene, 1-[(Butan-2-yl)oxy]-4-({4-[(propan-2-yl)oxy]phenyl}methoxy)benzene
| Molecular Formula | C20H26O3 |
| Molecular Weight | 314.1882 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 314.1882 Da |
| Heavy Atoms | 23 |
| Complexity | 302.0 |
| SMILES | CCC(C)OC1=CC=C(C=C1)OCC2=CC=C(C=C2)OC(C)C |
| InChIKey | ISRGUGUMABFBDS-UHFFFAOYSA-N |
The XLogP value of 5.5 indicates that 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene is 128631-94-7.
The molecular formula of 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene is C20H26O3.
The molecular weight of 1-Butan-2-yloxy-4-((4-propan-2-yloxyphenyl)methoxy)benzene is 314.1882 g/mol.
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