TL;DR: (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate (CAS 143121-08-8) is a chemical compound with molecular formula C11H11Cl2NO3 and molecular weight 275.0116 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,4-dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate
Also Known As: (2,4-dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate, 2,4-dichloro-5-hydroxyphenyl pyrrolidine-1-carboxylate, Pyrrolidine-1-carboxylic acid, (2,4-dichloro-5-hydroxyphenyl) ester, (2,4-dichloro-5-hydroxy-phenyl) Pyrrolidine-1-carboxylate, 1-Pyrrolidinecarboxylic acid 2,4-dichloro-5-hydroxyphenyl ester
| Molecular Formula | C11H11Cl2NO3 |
| Molecular Weight | 275.0116 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.0116 Da |
| Heavy Atoms | 17 |
| Complexity | 284.0 |
| SMILES | C1CCN(C1)C(=O)OC2=C(C=C(C(=C2)O)Cl)Cl |
| InChIKey | NNKDVXRNTGSXFM-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate is 143121-08-8.
The molecular formula of (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate is C11H11Cl2NO3.
The molecular weight of (2,4-Dichloro-5-hydroxyphenyl) pyrrolidine-1-carboxylate is 275.0116 g/mol.
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