TL;DR: 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans (CAS 110611-67-1) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trans-ethyl (1R,2R)-2-hydroxycyclopentane-1-carboxylate
Also Known As: Ethyl trans-2-Hydroxycyclopentanoate, Ethyl trans-2-hydroxycyclohexanecarboxylate, ethyl 2-hydroxycyclopentane-1-carboxylate, rel-Ethyl (1R,2R)-2-hydroxycyclopentanecarboxylate, Ethyl trans-2-hydroxycyclopentanecarboxylate
| Molecular Formula | C8H14O3 |
| Molecular Weight | 158.0943 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 158.0943 Da |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
| SMILES | CCOC(=O)[C@@H]1CCC[C@H]1O |
| InChIKey | IIFIGGNBUOZGAB-RNFRBKRXSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans 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 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans is 110611-67-1.
The molecular formula of 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans is C8H14O3.
The molecular weight of 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, trans is 158.0943 g/mol.
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