1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione
TL;DR: 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione (CAS 84634-64-0) is a chemical compound with molecular formula C15H11NO5 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione
Also Known As: 1-(2-hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione, 4,4-diethoxy-1-trifluoroacetamidobutane, 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(4-nitrophenyl)-, 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)-1,3-propanedione, 1-(4-Nitrophenyl)-3-(2-hydroxyphenyl)-1,3-propanedione
| Molecular Formula | C15H11NO5 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 2.7561 |
| Topological Polar Surface Area | 97.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.06372 |
| Heavy Atoms | 21 |
| Complexity | 706.25885 |
Chemical Identifiers
| CAS Number | 84634-64-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O |
Product Overview
1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione (CAS 84634-64-0), with molecular formula C15H11NO5 and molecular weight 285.06 g/mol. IUPAC: 1-(2-hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione.
Chemical Property Profile of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione
Property Insights of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione
The XLogP value of 2.7561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione. The TPSA of 97.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione. Following Lipinski's Rule of Five, 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione has 1 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 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione?
The CAS number of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione is 84634-64-0.
What is the molecular formula of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione?
The molecular formula of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione is C15H11NO5.
What is the molecular weight of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione?
The molecular weight of 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione is 285.06 g/mol.
Where can I buy 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione?
You can request a quote for 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.