![Methyl 4-[(4-nitrobenzyl)oxy]benzoate structure](/static/products/6229/62290-45-3.webp)
Methyl 4-[(4-nitrobenzyl)oxy]benzoate
TL;DR: Methyl 4-[(4-nitrobenzyl)oxy]benzoate (CAS 62290-45-3) is a chemical compound with molecular formula C15H13NO5 and molecular weight 287.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(4-nitrophenyl)methoxy]benzoate
Also Known As: methyl 4-[(4-nitrobenzyl)oxy]benzoate, methyl 4-[(4-nitrophenyl)methoxy]benzoate, Methyl 4-((4-nitrobenzyl)oxy)benzoate, methyl 4-(4-nitrobenzyloxy)benzoate, Methyl 4-(4-nitrobenzyl)oxybenzoate
| Molecular Formula | C15H13NO5 |
|---|---|
| Molecular Weight | 287.08 g/mol |
| LogP | 2.9604 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.07938 |
| Heavy Atoms | 21 |
| Complexity | 634.11847 |
Chemical Identifiers
| CAS Number | 62290-45-3 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)OCC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Methyl 4-[(4-nitrobenzyl)oxy]benzoate (CAS 62290-45-3), with molecular formula C15H13NO5 and molecular weight 287.08 g/mol. IUPAC: methyl 4-[(4-nitrophenyl)methoxy]benzoate.
Chemical Property Profile of Methyl 4-[(4-nitrobenzyl)oxy]benzoate
Property Insights of Methyl 4-[(4-nitrobenzyl)oxy]benzoate
The XLogP value of 2.9604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[(4-nitrobenzyl)oxy]benzoate. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[(4-nitrobenzyl)oxy]benzoate. Following Lipinski's Rule of Five, Methyl 4-[(4-nitrobenzyl)oxy]benzoate 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 4-[(4-nitrobenzyl)oxy]benzoate?
The CAS number of Methyl 4-[(4-nitrobenzyl)oxy]benzoate is 62290-45-3.
What is the molecular formula of Methyl 4-[(4-nitrobenzyl)oxy]benzoate?
The molecular formula of Methyl 4-[(4-nitrobenzyl)oxy]benzoate is C15H13NO5.
What is the molecular weight of Methyl 4-[(4-nitrobenzyl)oxy]benzoate?
The molecular weight of Methyl 4-[(4-nitrobenzyl)oxy]benzoate is 287.08 g/mol.
Where can I buy Methyl 4-[(4-nitrobenzyl)oxy]benzoate?
You can request a quote for Methyl 4-[(4-nitrobenzyl)oxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[(4-nitrobenzyl)oxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[(4-nitrobenzyl)oxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.