1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone
TL;DR: 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone (CAS 93716-97-3) is a chemical compound with molecular formula C14H10ClNO4 and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-chlorophenoxy)-3-nitrophenyl]ethanone
Also Known As: 1-(4-(4-chlorophenoxy)-3-nitrophenyl)ethanone, 1-[4-(4-chlorophenoxy)-3-nitrophenyl]ethanone, 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethan-1-one, 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone, AldrichCPR
| Molecular Formula | C14H10ClNO4 |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 4.2431 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.02985 |
| Heavy Atoms | 20 |
| Complexity | 667.37415 |
Chemical Identifiers
| CAS Number | 93716-97-3 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone (CAS 93716-97-3), with molecular formula C14H10ClNO4 and molecular weight 291.03 g/mol. IUPAC: 1-[4-(4-chlorophenoxy)-3-nitrophenyl]ethanone.
Chemical Property Profile of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone
Property Insights of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone
The XLogP value of 4.2431 indicates that 1-(4-(4-Chlorophenoxy)-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-Chlorophenoxy)-3-nitrophenyl)ethanone. Following Lipinski's Rule of Five, 1-(4-(4-Chlorophenoxy)-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-Chlorophenoxy)-3-nitrophenyl)ethanone?
The CAS number of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone is 93716-97-3.
What is the molecular formula of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone?
The molecular formula of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone is C14H10ClNO4.
What is the molecular weight of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone?
The molecular weight of 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone is 291.03 g/mol.
Where can I buy 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone?
You can request a quote for 1-(4-(4-Chlorophenoxy)-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-Chlorophenoxy)-3-nitrophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-(4-Chlorophenoxy)-3-nitrophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.