1-(2,4-Dinitrophenyl)-3-methylpiperidine
TL;DR: 1-(2,4-Dinitrophenyl)-3-methylpiperidine (CAS 117593-93-8) is a chemical compound with molecular formula C12H15N3O4 and molecular weight 265.10626 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,4-dinitrophenyl)-3-methylpiperidine
Also Known As: 1-(2,4-dinitrophenyl)-3-methylpiperidine
Technical Specifications
| Molecular Formula | C12H15N3O4 |
| Molecular Weight | 265.10626 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 265.10626 Da |
| Heavy Atoms | 19 |
| Complexity | 352.0 |
| SMILES | CC1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | QXBUWJWGHHJEBS-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,4-Dinitrophenyl)-3-methylpiperidine
Property Insights of 1-(2,4-Dinitrophenyl)-3-methylpiperidine
The XLogP value of 3.0 indicates that 1-(2,4-Dinitrophenyl)-3-methylpiperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dinitrophenyl)-3-methylpiperidine. Following Lipinski's Rule of Five, 1-(2,4-Dinitrophenyl)-3-methylpiperidine 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 1-(2,4-Dinitrophenyl)-3-methylpiperidine?
The CAS number of 1-(2,4-Dinitrophenyl)-3-methylpiperidine is 117593-93-8.
What is the molecular formula of 1-(2,4-Dinitrophenyl)-3-methylpiperidine?
The molecular formula of 1-(2,4-Dinitrophenyl)-3-methylpiperidine is C12H15N3O4.
What is the molecular weight of 1-(2,4-Dinitrophenyl)-3-methylpiperidine?
The molecular weight of 1-(2,4-Dinitrophenyl)-3-methylpiperidine is 265.10626 g/mol.
Where can I buy 1-(2,4-Dinitrophenyl)-3-methylpiperidine?
You can request a quote for 1-(2,4-Dinitrophenyl)-3-methylpiperidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,4-Dinitrophenyl)-3-methylpiperidine?
Yes, CoreyChem provides custom synthesis services for 1-(2,4-Dinitrophenyl)-3-methylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.