Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester
TL;DR: Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester (CAS 40325-00-6) is a chemical compound with molecular formula C7H6F3N7O14 and molecular weight 468.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-fluoro-2,2-dinitroethyl) N,N-bis(2-fluoro-2,2-dinitroethyl)carbamate
Also Known As: Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester, Carbamic acid bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester, 2-Fluoro-2,2-dinitroethyl bis(2-fluoro-2,2-dinitroethyl)carbamate, (2-fluoro-2,2-dinitroethyl) N,N-bis(2-fluoro-2,2-dinitroethyl)carbamate
| Molecular Formula | C7H6F3N7O14 |
|---|---|
| Molecular Weight | 468.99 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 304.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.9925 |
| Heavy Atoms | 31 |
| Complexity | 720.0 |
Chemical Identifiers
| CAS Number | 40325-00-6 |
|---|---|
| SMILES | C(C([N+](=O)[O-])([N+](=O)[O-])F)N(CC([N+](=O)[O-])([N+](=O)[O-])F)C(=O)OCC([N+](=O)[O-])([N+](=O)[O-])F |
| InChIKey | WPQWLDVIMCBQPN-UHFFFAOYSA-N |
Product Overview
Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester (CAS 40325-00-6), with molecular formula C7H6F3N7O14 and molecular weight 468.99 g/mol. IUPAC: (2-fluoro-2,2-dinitroethyl) N,N-bis(2-fluoro-2,2-dinitroethyl)carbamate.
Chemical Property Profile of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester
Property Insights of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester. The TPSA of 304.0 Ų indicates high polarity, suggesting Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester has 0 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester?
The CAS number of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester is 40325-00-6.
What is the molecular formula of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester?
The molecular formula of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester is C7H6F3N7O14.
What is the molecular weight of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester?
The molecular weight of Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester is 468.99 g/mol.
Where can I buy Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester?
You can request a quote for Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, bis(2-fluoro-2,2-dinitroethyl)-2-fluoro-2,2-dinitroethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.