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Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate
TL;DR: Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate (CAS 148729-22-0) is a chemical compound with molecular formula C15H20N2O4 and molecular weight 292.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate
Also Known As: CBKinase1_000215, CBKinase1_012615, Ethyl 1-(3-nitrobenzyl)piperdine-2-carboxylate, Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate, ETHYL1- PIPERDINE-2-CARBOXYLATE
| Molecular Formula | C15H20N2O4 |
|---|---|
| Molecular Weight | 292.14 g/mol |
| LogP | 2.5124 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.1423 |
| Heavy Atoms | 21 |
| Complexity | 518.15 |
Chemical Identifiers
| CAS Number | 148729-22-0 |
|---|---|
| SMILES | CCOC(=O)C1CCCCN1CC2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate (CAS 148729-22-0), with molecular formula C15H20N2O4 and molecular weight 292.14 g/mol. IUPAC: ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate.
Chemical Property Profile of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate
Property Insights of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate
The XLogP value of 2.5124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate has 0 hydrogen bond donor(s) and 5 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 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate?
The CAS number of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate is 148729-22-0.
What is the molecular formula of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate?
The molecular formula of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate is C15H20N2O4.
What is the molecular weight of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate?
The molecular weight of Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate is 292.14 g/mol.
Where can I buy Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate?
You can request a quote for Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[(3-nitrophenyl)methyl]piperidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.