Fluorodinitrophenylmethane
TL;DR: Fluorodinitrophenylmethane (CAS 17003-70-2) is a chemical compound with molecular formula C7H5FN2O4 and molecular weight 200.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[fluoro(dinitro)methyl]benzene
Also Known As: Fluorodinitrophenylmethane, (Fluorodinitromethyl)benzene, [fluoro(dinitro)methyl]benzene, Benzene, (fluorodinitromethyl)-, alpha-Fluoro-alpha,alpha-dinitrotoluene
| Molecular Formula | C7H5FN2O4 |
|---|---|
| Molecular Weight | 200.02 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.02333 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 17003-70-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C([N+](=O)[O-])([N+](=O)[O-])F |
| InChIKey | NPRRCIKUIFRPTB-UHFFFAOYSA-N |
Product Overview
Fluorodinitrophenylmethane (CAS 17003-70-2), with molecular formula C7H5FN2O4 and molecular weight 200.02 g/mol. IUPAC: [fluoro(dinitro)methyl]benzene.
Chemical Property Profile of Fluorodinitrophenylmethane
Property Insights of Fluorodinitrophenylmethane
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fluorodinitrophenylmethane. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluorodinitrophenylmethane. Following Lipinski's Rule of Five, Fluorodinitrophenylmethane has 0 hydrogen bond donor(s) and 5 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 Fluorodinitrophenylmethane?
The CAS number of Fluorodinitrophenylmethane is 17003-70-2.
What is the molecular formula of Fluorodinitrophenylmethane?
The molecular formula of Fluorodinitrophenylmethane is C7H5FN2O4.
What is the molecular weight of Fluorodinitrophenylmethane?
The molecular weight of Fluorodinitrophenylmethane is 200.02 g/mol.
Where can I buy Fluorodinitrophenylmethane?
You can request a quote for Fluorodinitrophenylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluorodinitrophenylmethane?
Yes, KEHONG BIO provides custom synthesis services for Fluorodinitrophenylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.