TL;DR: (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride (CAS 1049727-83-4) is a chemical compound with molecular formula C12H14Cl3NO2 and molecular weight 309.009 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(3,4-dichlorophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
Also Known As: starbld0000454, (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride, (R)-alpha-(3,4-dichloro-benzyl)-proline-HCl, 1101AA, H-{Bzl(3,4-Cl2)}Pro-OH HCl
| Molecular Formula | C12H14Cl3NO2 |
| Molecular Weight | 309.009 g/mol |
| XLogP | 3.1645 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.009 Da |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
| SMILES | C1C[C@@](NC1)(CC2=CC(=C(C=C2)Cl)Cl)C(=O)O.Cl |
| InChIKey | ZNAVYFGBDRNYAI-UTONKHPSSA-N |
The XLogP value of 3.1645 indicates that (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride has 3 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 (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride is 1049727-83-4.
The molecular formula of (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride is C12H14Cl3NO2.
The molecular weight of (R)-2-(3,4-Dichlorobenzyl)pyrrolidine-2-carboxylic acid hydrochloride is 309.009 g/mol.
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