TL;DR: Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)- (CAS 88737-62-6) is a chemical compound with molecular formula C13H14O3 and molecular weight 218.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-cyclopent-2-en-1-ylphenoxy)acetic acid
Also Known As: (4-(2-Cyclopenten-1-yl)phenoxy)acetic acid, alpha-(p-(Cyclopent-2-en-1-yl)phenoxy)acetic acid, ACETIC ACID, (4-(2-CYCLOPENTEN-1-YL)PHENOXY)-, 2-(4-cyclopent-2-en-1-ylphenoxy)acetic acid, [4-(Cyclopent-2-en-1-yl)phenoxy]acetic acid
| Molecular Formula | C13H14O3 |
| Molecular Weight | 218.0943 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.0943 Da |
| Heavy Atoms | 16 |
| Complexity | 264.0 |
| SMILES | C1CC(C=C1)C2=CC=C(C=C2)OCC(=O)O |
| InChIKey | NOFWTGTWDLFYGY-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)-. With a topological polar surface area (TPSA) of 46.5 Ų, Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)- is 88737-62-6.
The molecular formula of Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)- is C13H14O3.
The molecular weight of Acetic acid, (4-(2-cyclopenten-1-yl)phenoxy)- is 218.0943 g/mol.
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