TL;DR: 1-(3-Chlorophenyl)-1-cyclopropylethanol (CAS 1378874-55-5) is a chemical compound with molecular formula C11H13ClO and molecular weight 196.06549 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chlorophenyl)-1-cyclopropylethanol
Also Known As: 1-(3-chlorophenyl)-1-cyclopropylethanol, KST-1B8792, 1-(3-Chlorophenyl)-1-cyclopropyl ethanol, 1-(3-chlorophenyl)-1-cyclopropylethan-1-ol, 1-(3-chlorophenyl)-1-cyclopropyl-ethanol
| Molecular Formula | C11H13ClO |
| Molecular Weight | 196.06549 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.06549 Da |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
| SMILES | CC(C1CC1)(C2=CC(=CC=C2)Cl)O |
| InChIKey | ARMDJMJHMSKXQH-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chlorophenyl)-1-cyclopropylethanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-(3-Chlorophenyl)-1-cyclopropylethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-1-cyclopropylethanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(3-Chlorophenyl)-1-cyclopropylethanol is 1378874-55-5.
The molecular formula of 1-(3-Chlorophenyl)-1-cyclopropylethanol is C11H13ClO.
The molecular weight of 1-(3-Chlorophenyl)-1-cyclopropylethanol is 196.06549 g/mol.
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