4-Ethoxy-3-nitrochromen-2-one
TL;DR: 4-Ethoxy-3-nitrochromen-2-one (CAS 88353-19-9) is a chemical compound with molecular formula C11H9NO5 and molecular weight 235.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-3-nitrochromen-2-one
Also Known As: 4-ethoxy-3-nitrochromen-2-one, 4-Ethoxy-3-nitro-chromen-2-one, 4-ethoxy-3-nitro-2H-chromen-2-one, BAS 01052300, 3-Nitro-4-ethoxy-2H-1-benzopyran-2-one
| Molecular Formula | C11H9NO5 |
|---|---|
| Molecular Weight | 235.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.04807 |
| Heavy Atoms | 17 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 88353-19-9 |
|---|---|
| SMILES | CCOC1=C(C(=O)OC2=CC=CC=C21)[N+](=O)[O-] |
| InChIKey | QVXLOOZQQZPRCI-UHFFFAOYSA-N |
Product Overview
4-Ethoxy-3-nitrochromen-2-one (CAS 88353-19-9), with molecular formula C11H9NO5 and molecular weight 235.05 g/mol. IUPAC: 4-ethoxy-3-nitrochromen-2-one.
Chemical Property Profile of 4-Ethoxy-3-nitrochromen-2-one
Property Insights of 4-Ethoxy-3-nitrochromen-2-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethoxy-3-nitrochromen-2-one. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Ethoxy-3-nitrochromen-2-one. Following Lipinski's Rule of Five, 4-Ethoxy-3-nitrochromen-2-one 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 4-Ethoxy-3-nitrochromen-2-one?
The CAS number of 4-Ethoxy-3-nitrochromen-2-one is 88353-19-9.
What is the molecular formula of 4-Ethoxy-3-nitrochromen-2-one?
The molecular formula of 4-Ethoxy-3-nitrochromen-2-one is C11H9NO5.
What is the molecular weight of 4-Ethoxy-3-nitrochromen-2-one?
The molecular weight of 4-Ethoxy-3-nitrochromen-2-one is 235.05 g/mol.
Where can I buy 4-Ethoxy-3-nitrochromen-2-one?
You can request a quote for 4-Ethoxy-3-nitrochromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethoxy-3-nitrochromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethoxy-3-nitrochromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.