![methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate structure](/static/products/3008/300839-85-4.webp)
methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate
TL;DR: methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate (CAS 300839-85-4) is a chemical compound with molecular formula C18H13NO7 and molecular weight 355.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-(3-nitrophenyl)-2-oxochromen-7-yl]oxyacetate
Also Known As: EiM07-13875, methyl 2-{[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate, methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate, methyl 2-((4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl)oxy)acetate, methyl 2-[4-(3-nitrophenyl)-2-oxochromen-7-yl]oxyacetate
| Molecular Formula | C18H13NO7 |
|---|---|
| Molecular Weight | 355.07 g/mol |
| LogP | 2.92 |
| Topological Polar Surface Area | 108.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.0692 |
| Heavy Atoms | 26 |
| Complexity | 1054.8341 |
Chemical Identifiers
| CAS Number | 300839-85-4 |
|---|---|
| SMILES | COC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate (CAS 300839-85-4), with molecular formula C18H13NO7 and molecular weight 355.07 g/mol. IUPAC: methyl 2-[4-(3-nitrophenyl)-2-oxochromen-7-yl]oxyacetate.
Chemical Property Profile of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate
Property Insights of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate
The XLogP value of 2.92 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate. The TPSA of 108.88 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate. Following Lipinski's Rule of Five, methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate has 0 hydrogen bond donor(s) and 7 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-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate?
The CAS number of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate is 300839-85-4.
What is the molecular formula of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate?
The molecular formula of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate is C18H13NO7.
What is the molecular weight of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate?
The molecular weight of methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate is 355.07 g/mol.
Where can I buy methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate?
You can request a quote for methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl {[4-(3-nitrophenyl)-2-oxo-2H-chromen-7-yl]oxy}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.