Methyl 2-fluoro-4-nitrobenzoate
TL;DR: Methyl 2-fluoro-4-nitrobenzoate (CAS 392-09-6) is a chemical compound with molecular formula C8H6FNO4 and molecular weight 199.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-fluoro-4-nitrobenzoate
Also Known As: Methyl 2-fluoro-4-nitrobenzoate, Methyl 2-fluoro-4-nitrobenzenecarboxylate, Methyl-2-fluoro-4-nitrobenzoate, Enzalutamide Impurity 22, 2-FLUORO-4-NITROBENZOIC ACID METHYL ESTER
| Molecular Formula | C8H6FNO4 |
|---|---|
| Molecular Weight | 199.03 g/mol |
| LogP | 1.5205 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.02809 |
| Heavy Atoms | 14 |
| Complexity | 390.9277 |
Chemical Identifiers
| CAS Number | 392-09-6 |
|---|---|
| SMILES | COC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])F |
Product Overview
Methyl 2-fluoro-4-nitrobenzoate (CAS 392-09-6), with molecular formula C8H6FNO4 and molecular weight 199.03 g/mol. IUPAC: methyl 2-fluoro-4-nitrobenzoate.
Chemical Property Profile of Methyl 2-fluoro-4-nitrobenzoate
Property Insights of Methyl 2-fluoro-4-nitrobenzoate
The XLogP value of 1.5205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-fluoro-4-nitrobenzoate. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-fluoro-4-nitrobenzoate. Following Lipinski's Rule of Five, Methyl 2-fluoro-4-nitrobenzoate has 0 hydrogen bond donor(s) and 4 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 Methyl 2-fluoro-4-nitrobenzoate?
The CAS number of Methyl 2-fluoro-4-nitrobenzoate is 392-09-6.
What is the molecular formula of Methyl 2-fluoro-4-nitrobenzoate?
The molecular formula of Methyl 2-fluoro-4-nitrobenzoate is C8H6FNO4.
What is the molecular weight of Methyl 2-fluoro-4-nitrobenzoate?
The molecular weight of Methyl 2-fluoro-4-nitrobenzoate is 199.03 g/mol.
Where can I buy Methyl 2-fluoro-4-nitrobenzoate?
You can request a quote for Methyl 2-fluoro-4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-fluoro-4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-fluoro-4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.