2-Ethoxy-4-formyl-3-nitrophenyl acetate
TL;DR: 2-Ethoxy-4-formyl-3-nitrophenyl acetate (CAS 692280-66-3) is a chemical compound with molecular formula C11H11NO6 and molecular weight 253.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-4-formyl-3-nitrophenyl) acetate
Also Known As: 2-ethoxy-4-formyl-3-nitrophenyl acetate, (2-ethoxy-4-formyl-3-nitrophenyl) acetate, (2-ethoxy-4-formyl-3-nitro-phenyl) acetate, 4-(Acetyloxy)-3-ethoxy-2-nitrobenzaldehyde, Benzaldehyde, 4-(acetyloxy)-3-ethoxy-2-nitro-
| Molecular Formula | C11H11NO6 |
|---|---|
| Molecular Weight | 253.06 g/mol |
| LogP | 1.7313 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.05864 |
| Heavy Atoms | 18 |
| Complexity | 496.55197 |
Chemical Identifiers
| CAS Number | 692280-66-3 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1[N+](=O)[O-])C=O)OC(=O)C |
Product Overview
2-Ethoxy-4-formyl-3-nitrophenyl acetate (CAS 692280-66-3), with molecular formula C11H11NO6 and molecular weight 253.06 g/mol. IUPAC: (2-ethoxy-4-formyl-3-nitrophenyl) acetate.
Chemical Property Profile of 2-Ethoxy-4-formyl-3-nitrophenyl acetate
Property Insights of 2-Ethoxy-4-formyl-3-nitrophenyl acetate
The XLogP value of 1.7313 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethoxy-4-formyl-3-nitrophenyl acetate. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethoxy-4-formyl-3-nitrophenyl acetate. Following Lipinski's Rule of Five, 2-Ethoxy-4-formyl-3-nitrophenyl acetate 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-formyl-3-nitrophenyl acetate?
The CAS number of 2-Ethoxy-4-formyl-3-nitrophenyl acetate is 692280-66-3.
What is the molecular formula of 2-Ethoxy-4-formyl-3-nitrophenyl acetate?
The molecular formula of 2-Ethoxy-4-formyl-3-nitrophenyl acetate is C11H11NO6.
What is the molecular weight of 2-Ethoxy-4-formyl-3-nitrophenyl acetate?
The molecular weight of 2-Ethoxy-4-formyl-3-nitrophenyl acetate is 253.06 g/mol.
Where can I buy 2-Ethoxy-4-formyl-3-nitrophenyl acetate?
You can request a quote for 2-Ethoxy-4-formyl-3-nitrophenyl acetate 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-formyl-3-nitrophenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-4-formyl-3-nitrophenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.