1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one
TL;DR: 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one (CAS 13736-61-3) is a chemical compound with molecular formula C15H10ClNO3 and molecular weight 287.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one
Also Known As: 4-chloro-4'-nitro-benzophenone, 1-(4-chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one, RefChem:907357
| Molecular Formula | C15H10ClNO3 |
|---|---|
| Molecular Weight | 287.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.0349 |
| Heavy Atoms | 20 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 13736-61-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-] |
| InChIKey | JBXAGWCLKWPVFB-UHFFFAOYSA-N |
Product Overview
1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one (CAS 13736-61-3), with molecular formula C15H10ClNO3 and molecular weight 287.03 g/mol. IUPAC: 1-(4-chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one
Property Insights of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one
The XLogP value of 3.5 indicates that 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 3 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-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one?
The CAS number of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one is 13736-61-3.
What is the molecular formula of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one?
The molecular formula of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one is C15H10ClNO3.
What is the molecular weight of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one?
The molecular weight of 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one is 287.03 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one?
You can request a quote for 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-(4-nitrophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.