TL;DR: Lambda-Cyhalothric Acid Impurity 1 (CAS 104531-15-9) is a chemical compound with molecular formula C9H10ClF3O2 and molecular weight 242.03214 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-(1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid
Also Known As: Lambda-Cyhalothric Acid Impurity 1, trans-3-(2-Chloro-3,3,3-trifluoro-1-propenyl)-2,2-dimethyl-cyclopropanecarboxylic Acid, Cyclopropanecarboxylic acid, 3-(2-chloro-3,3,3-trifluoro-1-propenyl)-2,2-dimethyl-, trans-, (1R,3S)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid, (1R,3S)-3-((Z)-2-Chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropane-1-carboxylic acid
| Molecular Formula | C9H10ClF3O2 |
| Molecular Weight | 242.03214 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.03214 Da |
| Heavy Atoms | 15 |
| Complexity | 320.0 |
| SMILES | CC1([C@@H]([C@H]1C(=O)O)/C=C(/C(F)(F)F)\Cl)C |
| InChIKey | SPVZAYWHHVLPBN-FAAOWNOOSA-N |
The XLogP value of 3.4 indicates that Lambda-Cyhalothric Acid Impurity 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Lambda-Cyhalothric Acid Impurity 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lambda-Cyhalothric Acid Impurity 1 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Lambda-Cyhalothric Acid Impurity 1 is 104531-15-9.
The molecular formula of Lambda-Cyhalothric Acid Impurity 1 is C9H10ClF3O2.
The molecular weight of Lambda-Cyhalothric Acid Impurity 1 is 242.03214 g/mol.
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