TL;DR: (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid (CAS 142758-86-9) is a chemical compound with molecular formula C10H9ClO2 and molecular weight 196.02911 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-(1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid
Also Known As: Cis-2-(4-chlorophenyl)cyclopropanecarboxylic acid, (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid, (1R,2S)-2-(4-Chlorophenyl)cyclopropanecarboxylic Acid, Cyclopropanecarboxylic acid, 2-(4-chlorophenyl)-, cis-, H56250
| Molecular Formula | C10H9ClO2 |
| Molecular Weight | 196.02911 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.02911 Da |
| Heavy Atoms | 13 |
| Complexity | 209.0 |
| SMILES | C1[C@@H]([C@@H]1C(=O)O)C2=CC=C(C=C2)Cl |
| InChIKey | JZYXJKBNUJJIKU-RKDXNWHRSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid has 1 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 (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid is 142758-86-9.
The molecular formula of (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid is C10H9ClO2.
The molecular weight of (1R,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid is 196.02911 g/mol.
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