1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol
TL;DR: 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol (CAS 7508-08-9) is a chemical compound with molecular formula C19H17N3O8 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol
Also Known As: 1-ethyl-7-methoxy-naphthalene; 2,4,6-trinitrophenol, 1-ethyl-7-methoxynaphthalene; 2,4,6-trinitrophenol, 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol, 2,4,6-Trinitrophenol--1-ethyl-7-methoxynaphthalene (1/1)
| Molecular Formula | C19H17N3O8 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 4.5276 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 415.10156 |
| Heavy Atoms | 30 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 7508-08-9 |
|---|---|
| SMILES | CCC1=CC=CC2=C1C=C(C=C2)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ADRJJJNAFWSSGP-UHFFFAOYSA-N |
Product Overview
1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol (CAS 7508-08-9), with molecular formula C19H17N3O8 and molecular weight 415.10 g/mol. IUPAC: 1-ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol.
Chemical Property Profile of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol
Property Insights of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol
The XLogP value of 4.5276 indicates that 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol has 1 hydrogen bond donor(s) and 8 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-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol?
The CAS number of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol is 7508-08-9.
What is the molecular formula of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol?
The molecular formula of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol is C19H17N3O8.
What is the molecular weight of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol?
The molecular weight of 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol is 415.10 g/mol.
Where can I buy 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol?
You can request a quote for 1-Ethyl-7-methoxynaphthalene;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-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-7-methoxynaphthalene;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.