Methyl 4-oxopiperidine-3-carboxylate hydrochloride
TL;DR: Methyl 4-oxopiperidine-3-carboxylate hydrochloride (CAS 108554-34-3) is a chemical compound with molecular formula C7H12ClNO3 and molecular weight 193.05057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-oxopiperidine-3-carboxylate;hydrochloride
Also Known As: Methyl 4-oxopiperidine-3-carboxylate hydrochloride, Methyl 4-oxo-3-piperidinecarboxylate hydrochloride, EINECS 275-526-9, Methyl 4-oxopiperidine-3-carboxylate HCl, 3-Methoxycarbonyl-4-piperidone hydrochloride
Technical Specifications
| Molecular Formula | C7H12ClNO3 |
| Molecular Weight | 193.05057 g/mol |
| XLogP | -0.2402 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.05057 Da |
| Heavy Atoms | 12 |
| Complexity | 179.0 |
| SMILES | COC(=O)C1CNCCC1=O.Cl |
| InChIKey | NMAACQILAGCQPR-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-oxopiperidine-3-carboxylate hydrochloride
Property Insights of Methyl 4-oxopiperidine-3-carboxylate hydrochloride
The XLogP value of -0.2402 indicates that Methyl 4-oxopiperidine-3-carboxylate hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 4-oxopiperidine-3-carboxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-oxopiperidine-3-carboxylate hydrochloride has 2 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 Methyl 4-oxopiperidine-3-carboxylate hydrochloride?
The CAS number of Methyl 4-oxopiperidine-3-carboxylate hydrochloride is 108554-34-3.
What is the molecular formula of Methyl 4-oxopiperidine-3-carboxylate hydrochloride?
The molecular formula of Methyl 4-oxopiperidine-3-carboxylate hydrochloride is C7H12ClNO3.
What is the molecular weight of Methyl 4-oxopiperidine-3-carboxylate hydrochloride?
The molecular weight of Methyl 4-oxopiperidine-3-carboxylate hydrochloride is 193.05057 g/mol.
Where can I buy Methyl 4-oxopiperidine-3-carboxylate hydrochloride?
You can request a quote for Methyl 4-oxopiperidine-3-carboxylate hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-oxopiperidine-3-carboxylate hydrochloride?
Yes, CoreyChem provides custom synthesis services for Methyl 4-oxopiperidine-3-carboxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.