2,4,6-Trinitrophenol-azecane(1:1)
TL;DR: 2,4,6-Trinitrophenol-azecane(1:1) (CAS 51206-66-7) is a chemical compound with molecular formula C15H22N4O7 and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azecane;2,4,6-trinitrophenol
Also Known As: 2,4,6-trinitrophenol- azecane(1:1), azecane,2,4,6-trinitrophenol, azecane; 2,4,6-trinitrophenol, 2,4,6-trinitrophenol-azecane(1:1), 2,4,6-Trinitrophenol--azecane (1/1)
| Molecular Formula | C15H22N4O7 |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 3.4371 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 370.14883 |
| Heavy Atoms | 26 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 51206-66-7 |
|---|---|
| SMILES | C1CCCCNCCCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | PSNATKLWAKGAQK-UHFFFAOYSA-N |
Product Overview
2,4,6-Trinitrophenol-azecane(1:1) (CAS 51206-66-7), with molecular formula C15H22N4O7 and molecular weight 370.15 g/mol. IUPAC: azecane;2,4,6-trinitrophenol.
Chemical Property Profile of 2,4,6-Trinitrophenol-azecane(1:1)
Property Insights of 2,4,6-Trinitrophenol-azecane(1:1)
The XLogP value of 3.4371 indicates that 2,4,6-Trinitrophenol-azecane(1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 170.0 Ų indicates high polarity, suggesting 2,4,6-Trinitrophenol-azecane(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4,6-Trinitrophenol-azecane(1:1) has 2 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 2,4,6-Trinitrophenol-azecane(1:1)?
The CAS number of 2,4,6-Trinitrophenol-azecane(1:1) is 51206-66-7.
What is the molecular formula of 2,4,6-Trinitrophenol-azecane(1:1)?
The molecular formula of 2,4,6-Trinitrophenol-azecane(1:1) is C15H22N4O7.
What is the molecular weight of 2,4,6-Trinitrophenol-azecane(1:1)?
The molecular weight of 2,4,6-Trinitrophenol-azecane(1:1) is 370.15 g/mol.
Where can I buy 2,4,6-Trinitrophenol-azecane(1:1)?
You can request a quote for 2,4,6-Trinitrophenol-azecane(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trinitrophenol-azecane(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trinitrophenol-azecane(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.