1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-
TL;DR: 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- (CAS 84634-63-9) 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-(2-nitrophenyl)propane-1,3-dione
Also Known As: 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)propane-1,3-dione, 3-bromo-5-nitro-2-hydroxycinnamaldehyde, 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-, J2.204.312I, 1-(2-hydroxyphenyl)-3-(nitrophenyl)propan-1,3-dione
| 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 | 723.50885 |
Chemical Identifiers
| CAS Number | 84634-63-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)CC(=O)C2=CC=CC=C2O)[N+](=O)[O-] |
Product Overview
1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- (CAS 84634-63-9), with molecular formula C15H11NO5 and molecular weight 285.06 g/mol. IUPAC: 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)propane-1,3-dione.
Chemical Property Profile of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-
Property Insights of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-
The XLogP value of 2.7561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-. The TPSA of 97.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-. Following Lipinski's Rule of Five, 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- 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 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-?
The CAS number of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- is 84634-63-9.
What is the molecular formula of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-?
The molecular formula of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- is C15H11NO5.
What is the molecular weight of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-?
The molecular weight of 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- is 285.06 g/mol.
Where can I buy 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-?
You can request a quote for 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanedione, 1-(2-hydroxyphenyl)-3-(2-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.