7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate
TL;DR: 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate (CAS 307341-20-4) is a chemical compound with molecular formula C19H13NO8 and molecular weight 383.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-acetyloxy-4-(4-nitrophenyl)-2-oxochromen-7-yl] acetate
Also Known As: 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate, AB00684149-01, F0307-0518, 5-acetoxy-4-(p-nitrophenyl)-7-coumarinyl acetate, 4-(4-nitrophenyl)-2-oxo-2H-chromene-5,7-diyl diacetate
| Molecular Formula | C19H13NO8 |
|---|---|
| Molecular Weight | 383.06 g/mol |
| LogP | 3.2188 |
| Topological Polar Surface Area | 125.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.06412 |
| Heavy Atoms | 28 |
| Complexity | 1161.0074 |
Chemical Identifiers
| CAS Number | 307341-20-4 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C(=CC(=O)O2)C3=CC=C(C=C3)[N+](=O)[O-])C(=C1)OC(=O)C |
Product Overview
7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate (CAS 307341-20-4), with molecular formula C19H13NO8 and molecular weight 383.06 g/mol. IUPAC: [5-acetyloxy-4-(4-nitrophenyl)-2-oxochromen-7-yl] acetate.
Chemical Property Profile of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate
Property Insights of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate
The XLogP value of 3.2188 indicates that 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate. Following Lipinski's Rule of Five, 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate has 0 hydrogen bond donor(s) and 8 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 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate?
The CAS number of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate is 307341-20-4.
What is the molecular formula of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate?
The molecular formula of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate is C19H13NO8.
What is the molecular weight of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate?
The molecular weight of 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate is 383.06 g/mol.
Where can I buy 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate?
You can request a quote for 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 7-(acetyloxy)-4-(4-nitrophenyl)-2-oxo-2H-chromen-5-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.