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Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate
TL;DR: Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate (CAS 170843-57-9) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate
Also Known As: Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate, 3-[(4-methylphenyl)methyl]-3-Piperidinecarboxylic acid ethyl ester
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 2.47042 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 418.88 |
Chemical Identifiers
| CAS Number | 170843-57-9 |
|---|---|
| SMILES | CCOC(=O)C1(CCCNC1)CC2=CC=C(C=C2)C |
Product Overview
Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate (CAS 170843-57-9), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate.
Chemical Property Profile of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate
Property Insights of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate
The XLogP value of 2.47042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate. With a topological polar surface area (TPSA) of 38.33 Ų, Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate?
The CAS number of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate is 170843-57-9.
What is the molecular formula of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate?
The molecular formula of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate is C16H23NO2.
What is the molecular weight of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate?
The molecular weight of Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate is 261.17 g/mol.
Where can I buy Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate?
You can request a quote for Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[(4-methylphenyl)methyl]piperidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.