TL;DR: 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1) (CAS 154956-79-3) is a chemical compound with molecular formula C10H13Cl2NO and molecular weight 233.03741 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-chlorophenyl)pyrrolidin-3-ol;hydrochloride
Also Known As: 3-(4-chlorophenyl)pyrrolidin-3-ol hydrochloride, 3-(p-Chlorophenyl)-3-pyrrolidinol hydrochloride, 3-(4-CHLOROPHENYL)PYRROLIDIN-3-OL HCL, 3-(4-chlorophenyl)pyrrolidin-3-ol;hydrochloride, 3-Pyrrolidinol, 3-(p-chlorophenyl)-, hydrochloride
| Molecular Formula | C10H13Cl2NO |
| Molecular Weight | 233.03741 g/mol |
| XLogP | 1.9427 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.03741 Da |
| Heavy Atoms | 14 |
| Complexity | 180.0 |
| SMILES | C1CNCC1(C2=CC=C(C=C2)Cl)O.Cl |
| InChIKey | OABQNRFBTRGANN-UHFFFAOYSA-N |
The XLogP value of 1.9427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 32.3 Ų, 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1) has 3 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 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1) is 154956-79-3.
The molecular formula of 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1) is C10H13Cl2NO.
The molecular weight of 3-(4-Chlorophenyl)pyrrolidin-3-ol--hydrogen chloride (1/1) is 233.03741 g/mol.
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