1-(3-Chlorophenyl)-2-phenylethane-1,2-dione
TL;DR: 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione (CAS 7498-72-8) is a chemical compound with molecular formula C14H9ClO2 and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-2-phenylethane-1,2-dione
Also Known As: m-Chlorbenzil, 3-chlorobenzil, 1-(3-chlorophenyl)-2-phenylethane-1,2-dione, 1-(3-chlorophenyl)-2-phenylethanedione, 1-(3-chlorophenyl)-2-phenyl-ethane-1,2-dione
| Molecular Formula | C14H9ClO2 |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.02911 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 7498-72-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(=O)C2=CC(=CC=C2)Cl |
| InChIKey | QNWDCWUUOFHMHH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3-Chlorophenyl)-2-phenylethane-1,2-dione (CAS 7498-72-8), with molecular formula C14H9ClO2 and molecular weight 244.03 g/mol. IUPAC: 1-(3-chlorophenyl)-2-phenylethane-1,2-dione.
Chemical Property Profile of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione
Property Insights of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione
The XLogP value of 4.0 indicates that 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione has 0 hydrogen bond donor(s) and 2 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-(3-Chlorophenyl)-2-phenylethane-1,2-dione?
The CAS number of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione is 7498-72-8.
What is the molecular formula of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione?
The molecular formula of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione is C14H9ClO2.
What is the molecular weight of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione?
The molecular weight of 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione is 244.03 g/mol.
Where can I buy 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione?
You can request a quote for 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chlorophenyl)-2-phenylethane-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.