3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
TL;DR: 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one (CAS 1321913-27-2) is a chemical compound with molecular formula C16H13NO4 and molecular weight 283.08447 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
Also Known As: 3-(3-methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one, (2E)-3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C16H13NO4 |
| Molecular Weight | 283.08447 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.08447 Da |
| Heavy Atoms | 21 |
| Complexity | 402.0 |
| SMILES | COC1=CC=CC(=C1)C=CC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | ZBCOZCVPNSNSKF-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
Property Insights of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
The XLogP value of 3.5 indicates that 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one?
The CAS number of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one is 1321913-27-2.
What is the molecular formula of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one?
The molecular formula of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one is C16H13NO4.
What is the molecular weight of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one?
The molecular weight of 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one is 283.08447 g/mol.
Where can I buy 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one?
You can request a quote for 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 3-(3-Methoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.