1-氟-2,4-二硝基苯
TL;DR: 1-氟-2,4-二硝基苯 (CAS 70-34-8) is a chemical compound with molecular formula C6H3FN2O4 and molecular weight 186.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-氟-2,4-二硝基苯
1-fluoro-2,4-dinitrobenzene
Also Known As: 2,4-Dinitrofluorobenzene, 1-FLUORO-2,4-DINITROBENZENE, Dinitrofluorobenzene, FDNB, Sanger's Reagent
| Molecular Formula | C6H3FN2O4 |
|---|---|
| Molecular Weight | 186.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.00769 |
| Heavy Atoms | 13 |
| Complexity | 224.0 |
| Melting Point | 81.5 to 30.0 °C |
| Boiling Point | 296.1 °C at 760 mmHg ; 177.8 °C at 25 mmHg ; 132.8 °C at 2 mmHg |
| Density | 1.482 at 20.0 °C |
| Solubility | 0.1 to 1.0 mg/mL at 67.5 °F (NTP, 1992) |
| Flash Point | greater than 112.8 °C |
| Vapor Pressure | 0.0024 [mmHg] |
| Refractive Index | 1.5690 at 20 °C |
Chemical Identifiers
| CAS Number | 70-34-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F |
| InChIKey | LOTKRQAVGJMPNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-氟-2,4-二硝基苯 (CAS 70-34-8), with molecular formula C6H3FN2O4 and molecular weight 186.01 g/mol. IUPAC: 1-fluoro-2,4-dinitrobenzene.
Chemical Property Profile of 1-氟-2,4-二硝基苯
Property Insights of 1-氟-2,4-二硝基苯
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-氟-2,4-二硝基苯. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-氟-2,4-二硝基苯. Following Lipinski's Rule of Five, 1-氟-2,4-二硝基苯 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 1-氟-2,4-二硝基苯?
The CAS number of 1-氟-2,4-二硝基苯 is 70-34-8.
What is the molecular formula of 1-氟-2,4-二硝基苯?
The molecular formula of 1-氟-2,4-二硝基苯 is C6H3FN2O4.
What is the molecular weight of 1-氟-2,4-二硝基苯?
The molecular weight of 1-氟-2,4-二硝基苯 is 186.01 g/mol.
Where can I buy 1-氟-2,4-二硝基苯?
You can request a quote for 1-氟-2,4-二硝基苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-氟-2,4-二硝基苯?
Yes, KEHONG BIO provides custom synthesis services for 1-氟-2,4-二硝基苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.