Methyl 2-(5-fluoro-2-nitrophenoxy)acetate
TL;DR: Methyl 2-(5-fluoro-2-nitrophenoxy)acetate (CAS 116355-65-8) is a chemical compound with molecular formula C9H8FNO5 and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(5-fluoro-2-nitrophenoxy)acetate
Also Known As: methyl 2-(5-fluoro-2-nitrophenoxy)acetate, Methyl 5-fluoro-2-nitrophenoxyacetate, Methyl (5-fluoro-2-nitrophenoxy)acetate, methyl 2-(5-fluoro-2-nitro-phenoxy)acetate, Acetic acid, (5-fluoro-2-nitrophenoxy)-, methyl ester
| Molecular Formula | C9H8FNO5 |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 1.2857 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.03865 |
| Heavy Atoms | 16 |
| Complexity | 420.3604 |
Chemical Identifiers
| CAS Number | 116355-65-8 |
|---|---|
| SMILES | COC(=O)COC1=C(C=CC(=C1)F)[N+](=O)[O-] |
Product Overview
Methyl 2-(5-fluoro-2-nitrophenoxy)acetate (CAS 116355-65-8), with molecular formula C9H8FNO5 and molecular weight 229.04 g/mol. IUPAC: methyl 2-(5-fluoro-2-nitrophenoxy)acetate.
Chemical Property Profile of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate
Property Insights of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate
The XLogP value of 1.2857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(5-fluoro-2-nitrophenoxy)acetate. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(5-fluoro-2-nitrophenoxy)acetate. Following Lipinski's Rule of Five, Methyl 2-(5-fluoro-2-nitrophenoxy)acetate 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 Methyl 2-(5-fluoro-2-nitrophenoxy)acetate?
The CAS number of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate is 116355-65-8.
What is the molecular formula of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate?
The molecular formula of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate is C9H8FNO5.
What is the molecular weight of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate?
The molecular weight of Methyl 2-(5-fluoro-2-nitrophenoxy)acetate is 229.04 g/mol.
Where can I buy Methyl 2-(5-fluoro-2-nitrophenoxy)acetate?
You can request a quote for Methyl 2-(5-fluoro-2-nitrophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(5-fluoro-2-nitrophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(5-fluoro-2-nitrophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.