四(2-氟-2,2-二硝基乙基)原碳酸酯
TL;DR: 四(2-氟-2,2-二硝基乙基)原碳酸酯 (CAS 20786-75-8) is a chemical compound with molecular formula C9H8F4N8O20 and molecular weight 623.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
四(2-氟-2,2-二硝基乙基)原碳酸酯
1-fluoro-1,1-dinitro-2-[tris(2-fluoro-2,2-dinitroethoxy)methoxy]ethane
Also Known As: Tetrakis(2-fluoro-2,2-dinitroethyl) orthocarbonate, Disilene,tetrakis(2,4-dimethylphenyl), 1-fluoro-1,1-dinitro-2-[tris(2-fluoro-2,2-dinitroethoxy)methoxy]ethane, tetrakis(2-fluoro-2,2-dinitroethoxy)methane, Orthocarbonic acid tetrakis(2-fluoro-2,2-dinitroethyl) ester
| Molecular Formula | C9H8F4N8O20 |
|---|---|
| Molecular Weight | 623.98 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 403.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 12 |
| Exact Mass | 623.9791 |
| Heavy Atoms | 41 |
| Complexity | 862.0 |
Chemical Identifiers
| CAS Number | 20786-75-8 |
|---|---|
| SMILES | C(C([N+](=O)[O-])([N+](=O)[O-])F)OC(OCC([N+](=O)[O-])([N+](=O)[O-])F)(OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F |
| InChIKey | OXTSVLSXTUKQMY-UHFFFAOYSA-N |
Product Overview
四(2-氟-2,2-二硝基乙基)原碳酸酯 (CAS 20786-75-8), with molecular formula C9H8F4N8O20 and molecular weight 623.98 g/mol. IUPAC: 1-fluoro-1,1-dinitro-2-[tris(2-fluoro-2,2-dinitroethoxy)methoxy]ethane.
Chemical Property Profile of 四(2-氟-2,2-二硝基乙基)原碳酸酯
Property Insights of 四(2-氟-2,2-二硝基乙基)原碳酸酯
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 四(2-氟-2,2-二硝基乙基)原碳酸酯. The TPSA of 403.0 Ų indicates high polarity, suggesting 四(2-氟-2,2-二硝基乙基)原碳酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 四(2-氟-2,2-二硝基乙基)原碳酸酯 has 0 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 四(2-氟-2,2-二硝基乙基)原碳酸酯?
The CAS number of 四(2-氟-2,2-二硝基乙基)原碳酸酯 is 20786-75-8.
What is the molecular formula of 四(2-氟-2,2-二硝基乙基)原碳酸酯?
The molecular formula of 四(2-氟-2,2-二硝基乙基)原碳酸酯 is C9H8F4N8O20.
What is the molecular weight of 四(2-氟-2,2-二硝基乙基)原碳酸酯?
The molecular weight of 四(2-氟-2,2-二硝基乙基)原碳酸酯 is 623.98 g/mol.
Where can I buy 四(2-氟-2,2-二硝基乙基)原碳酸酯?
You can request a quote for 四(2-氟-2,2-二硝基乙基)原碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 四(2-氟-2,2-二硝基乙基)原碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 四(2-氟-2,2-二硝基乙基)原碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.