TL;DR: (2S)-Ethyl 2-phenylcyclopropanecarboxylate (CAS 1315055-85-6) is a chemical compound with molecular formula C12H14O2 and molecular weight 190.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2S)-2-phenylcyclopropane-1-carboxylate
Also Known As: (2S)-Ethyl 2-phenylcyclopropanecarboxylate, (1S,2S)-ethyl 2-phenylcyclopropanecarboxylate, ethyl (2S)-2-phenylcyclopropane-1-carboxylate, 2-Phenylcyclopropanecarboxylic acid, ethyl ester
| Molecular Formula | C12H14O2 |
| Molecular Weight | 190.09938 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.09938 Da |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
| SMILES | CCOC(=O)C1C[C@@H]1C2=CC=CC=C2 |
| InChIKey | SRGUIJLJERBBCM-NFJWQWPMSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-Ethyl 2-phenylcyclopropanecarboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, (2S)-Ethyl 2-phenylcyclopropanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-Ethyl 2-phenylcyclopropanecarboxylate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S)-Ethyl 2-phenylcyclopropanecarboxylate is 1315055-85-6.
The molecular formula of (2S)-Ethyl 2-phenylcyclopropanecarboxylate is C12H14O2.
The molecular weight of (2S)-Ethyl 2-phenylcyclopropanecarboxylate is 190.09938 g/mol.
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