![1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone structure](/static/products/314/31477-15-3.png)
1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone
TL;DR: 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone (CAS 31477-15-3) is a chemical compound with molecular formula C15H13NO4 and molecular weight 271.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-methylphenoxy)-3-nitrophenyl]ethanone
Also Known As: 1-(4-(p-Tolyloxy)-3-nitrophenyl)ethanone, 1-[4-(4-methylphenoxy)-3-nitrophenyl]ethanone, 1-(3-Nitro-4-(p-tolyloxy)phenyl)ethan-1-one, 1-(4-(p-Tolyloxy)-3-nitrophenyl)ethanone, AldrichCPR
| Molecular Formula | C15H13NO4 |
|---|---|
| Molecular Weight | 271.08 g/mol |
| LogP | 3.89812 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.08447 |
| Heavy Atoms | 20 |
| Complexity | 662.0738 |
Chemical Identifiers
| CAS Number | 31477-15-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(=O)C)[N+](=O)[O-] |
Product Overview
1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone (CAS 31477-15-3), with molecular formula C15H13NO4 and molecular weight 271.08 g/mol. IUPAC: 1-[4-(4-methylphenoxy)-3-nitrophenyl]ethanone.
Chemical Property Profile of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone
Property Insights of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone
The XLogP value of 3.89812 indicates that 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone. Following Lipinski's Rule of Five, 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone 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
Frequently Asked Questions
What is the CAS number of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone?
The CAS number of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone is 31477-15-3.
What is the molecular formula of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone?
The molecular formula of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone is C15H13NO4.
What is the molecular weight of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone?
The molecular weight of 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone is 271.08 g/mol.
Where can I buy 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone?
You can request a quote for 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(4-Methylphenoxy)-3-nitrophenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.