2-Ethoxy-4-formylphenyl 3-nitrobenzoate
TL;DR: 2-Ethoxy-4-formylphenyl 3-nitrobenzoate (CAS 359644-61-4) is a chemical compound with molecular formula C16H13NO6 and molecular weight 315.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-4-formylphenyl) 3-nitrobenzoate
Also Known As: 2-ethoxy-4-formylphenyl 3-nitrobenzoate, (2-ethoxy-4-formylphenyl) 3-nitrobenzoate
| Molecular Formula | C16H13NO6 |
|---|---|
| Molecular Weight | 315.07 g/mol |
| LogP | 3.0252 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.07428 |
| Heavy Atoms | 23 |
| Complexity | 755.9857 |
Chemical Identifiers
| CAS Number | 359644-61-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=O)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
2-Ethoxy-4-formylphenyl 3-nitrobenzoate (CAS 359644-61-4), with molecular formula C16H13NO6 and molecular weight 315.07 g/mol. IUPAC: (2-ethoxy-4-formylphenyl) 3-nitrobenzoate.
Chemical Property Profile of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate
Property Insights of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate
The XLogP value of 3.0252 indicates that 2-Ethoxy-4-formylphenyl 3-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethoxy-4-formylphenyl 3-nitrobenzoate. Following Lipinski's Rule of Five, 2-Ethoxy-4-formylphenyl 3-nitrobenzoate has 0 hydrogen bond donor(s) and 6 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 2-Ethoxy-4-formylphenyl 3-nitrobenzoate?
The CAS number of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate is 359644-61-4.
What is the molecular formula of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate?
The molecular formula of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate is C16H13NO6.
What is the molecular weight of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate?
The molecular weight of 2-Ethoxy-4-formylphenyl 3-nitrobenzoate is 315.07 g/mol.
Where can I buy 2-Ethoxy-4-formylphenyl 3-nitrobenzoate?
You can request a quote for 2-Ethoxy-4-formylphenyl 3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethoxy-4-formylphenyl 3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-4-formylphenyl 3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.