1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane
TL;DR: 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane (CAS 32833-80-0) is a chemical compound with molecular formula C5H7FN6O10 and molecular weight 330.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,2-dinitropropyl)-N-(2-fluoro-2,2-dinitroethyl)nitramide
Also Known As: 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane, N-(2,2-dinitropropyl)-N-(2-fluoro-2,2-dinitroethyl)nitramide, N-Nitro(2-fluoro-2,2-dinitroethyl)2,2-dinitro-propyl)amine, RefChem:230476
| Molecular Formula | C5H7FN6O10 |
|---|---|
| Molecular Weight | 330.02 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 232.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.02078 |
| Heavy Atoms | 22 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 32833-80-0 |
|---|---|
| SMILES | CC(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CHOWAPMCIOTBEI-UHFFFAOYSA-N |
Product Overview
1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane (CAS 32833-80-0), with molecular formula C5H7FN6O10 and molecular weight 330.02 g/mol. IUPAC: N-(2,2-dinitropropyl)-N-(2-fluoro-2,2-dinitroethyl)nitramide.
Chemical Property Profile of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane
Property Insights of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane. The TPSA of 232.0 Ų indicates high polarity, suggesting 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane?
The CAS number of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane is 32833-80-0.
What is the molecular formula of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane?
The molecular formula of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane is C5H7FN6O10.
What is the molecular weight of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane?
The molecular weight of 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane is 330.02 g/mol.
Where can I buy 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane?
You can request a quote for 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluoro-1,1,3,5,5-pentanitro-3-azahexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.