1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone
TL;DR: 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone (CAS 137987-89-4) is a chemical compound with molecular formula C14H11NO6 and molecular weight 289.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone
Also Known As: 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone, Ethanone, 1-(2,4-dihydroxyphenyl)-2-(4-nitrophenoxy)-, 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethan-1-one, 652-370-3, BRN 5444940
| Molecular Formula | C14H11NO6 |
|---|---|
| Molecular Weight | 289.06 g/mol |
| LogP | 2.2677 |
| Topological Polar Surface Area | 109.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.05862 |
| Heavy Atoms | 21 |
| Complexity | 680.36365 |
Chemical Identifiers
| CAS Number | 137987-89-4 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)C2=C(C=C(C=C2)O)O |
Product Overview
1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone (CAS 137987-89-4), with molecular formula C14H11NO6 and molecular weight 289.06 g/mol. IUPAC: 1-(2,4-dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone.
Chemical Property Profile of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone
Property Insights of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone
The XLogP value of 2.2677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone. The TPSA of 109.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone. Following Lipinski's Rule of Five, 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone has 2 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 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone?
The CAS number of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone is 137987-89-4.
What is the molecular formula of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone?
The molecular formula of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone is C14H11NO6.
What is the molecular weight of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone?
The molecular weight of 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone is 289.06 g/mol.
Where can I buy 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone?
You can request a quote for 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dihydroxyphenyl)-2-(4-nitrophenoxy)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.