Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate
TL;DR: Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate (CAS 1285962-63-1) is a chemical compound with molecular formula C13H15ClN2O4 and molecular weight 298.07202 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate
Also Known As: methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate, methyl1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate
Technical Specifications
| Molecular Formula | C13H15ClN2O4 |
| Molecular Weight | 298.07202 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.07202 Da |
| Heavy Atoms | 20 |
| Complexity | 366.0 |
| SMILES | COC(=O)C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | DMYQPUYXBPASLM-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate
Property Insights of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate. Following Lipinski's Rule of Five, Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-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
What is the CAS number of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate?
The CAS number of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate is 1285962-63-1.
What is the molecular formula of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate?
The molecular formula of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate is C13H15ClN2O4.
What is the molecular weight of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate?
The molecular weight of Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate is 298.07202 g/mol.
Where can I buy Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate?
You can request a quote for Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 1-(2-chloro-4-nitrophenyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.