1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone
TL;DR: 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone (CAS 69511-77-9) is a chemical compound with molecular formula C16H15NO5 and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dimethoxy-2-nitrophenyl)-2-phenylethanone
Also Known As: 1-(4,5-dimethoxy-2-nitrophenyl)-2-phenylethanone, 1-(4,5-Dimethoxy-2-nitro-phenyl)-2-phenyl-ethanone
| Molecular Formula | C16H15NO5 |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 3.0374 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.09503 |
| Heavy Atoms | 22 |
| Complexity | 697.1824 |
Chemical Identifiers
| CAS Number | 69511-77-9 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)CC2=CC=CC=C2)[N+](=O)[O-])OC |
Product Overview
1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone (CAS 69511-77-9), with molecular formula C16H15NO5 and molecular weight 301.10 g/mol. IUPAC: 1-(4,5-dimethoxy-2-nitrophenyl)-2-phenylethanone.
Chemical Property Profile of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone
Property Insights of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone
The XLogP value of 3.0374 indicates that 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone. Following Lipinski's Rule of Five, 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone has 0 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-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone?
The CAS number of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone is 69511-77-9.
What is the molecular formula of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone?
The molecular formula of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone is C16H15NO5.
What is the molecular weight of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone?
The molecular weight of 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone is 301.10 g/mol.
Where can I buy 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone?
You can request a quote for 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,5-Dimethoxy-2-nitrophenyl)-2-phenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.