![1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol structure](/static/products/920/92059-44-4.png)
1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol
TL;DR: 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol (CAS 92059-44-4) is a chemical compound with molecular formula C17H20N4O8 and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5-methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol
Also Known As: 2,4,6-trinitrophenol- 1-[(5-methylfuran-2-yl)methyl]piperidine(1:1), 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol, 1-[(5-methylfuran-2-yl)methyl]piperidine; 2,4,6-trinitrophenol, 2,4,6-Trinitrophenol--1-[(5-methylfuran-2-yl)methyl]piperidine (1/1)
| Molecular Formula | C17H20N4O8 |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 3.69072 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 408.1281 |
| Heavy Atoms | 29 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 92059-44-4 |
|---|---|
| SMILES | CC1=CC=C(O1)CN2CCCCC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | HZQOMJROPYSDIO-UHFFFAOYSA-N |
Product Overview
1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol (CAS 92059-44-4), with molecular formula C17H20N4O8 and molecular weight 408.13 g/mol. IUPAC: 1-[(5-methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol.
Chemical Property Profile of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol
Property Insights of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol
The XLogP value of 3.69072 indicates that 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 174.0 Ų indicates high polarity, suggesting 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol has 1 hydrogen bond donor(s) and 9 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 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol?
The CAS number of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol is 92059-44-4.
What is the molecular formula of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol?
The molecular formula of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol is C17H20N4O8.
What is the molecular weight of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol?
The molecular weight of 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol is 408.13 g/mol.
Where can I buy 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol?
You can request a quote for 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-Methylfuran-2-yl)methyl]piperidine;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.