1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride
TL;DR: 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride (CAS 1052512-99-8) is a chemical compound with molecular formula C13H17Cl2NO2 and molecular weight 289.06363 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-methylpiperidin-3-yl) 2-chlorobenzoate;hydrochloride
Also Known As: (1-methylpiperidin-3-yl) 2-chlorobenzoate hydrochloride, 1-METHYLPIPERIDIN-3-YL 2-CHLOROBENZOATE HYDROCHLORIDE
Technical Specifications
| Molecular Formula | C13H17Cl2NO2 |
| Molecular Weight | 289.06363 g/mol |
| XLogP | 3.0128 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.06363 Da |
| Heavy Atoms | 18 |
| Complexity | 272.0 |
| SMILES | CN1CCCC(C1)OC(=O)C2=CC=CC=C2Cl.Cl |
| InChIKey | VMAISMYVDNWQFF-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride
Property Insights of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride
The XLogP value of 3.0128 indicates that 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride?
The CAS number of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride is 1052512-99-8.
What is the molecular formula of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride?
The molecular formula of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride is C13H17Cl2NO2.
What is the molecular weight of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride?
The molecular weight of 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride is 289.06363 g/mol.
Where can I buy 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride?
You can request a quote for 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-Methylpiperidin-3-YL 2-chlorobenzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.