Chlorochalcone
TL;DR: Chlorochalcone (CAS 22966-11-6) is a chemical compound with molecular formula C15H11ClO and molecular weight 242.04984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-chlorophenyl)-1-phenylprop-2-en-1-one
Also Known As: 2-Chlorochalcone, chlorochalcone, 2-Chlorobenzylideneacetophenone, 2-Chlorochalcone, predominantly trans, 3-(2-Chlorophenyl)-1-phenylprop-2-en-1-one
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H11ClO |
| Molecular Weight | 242.04984 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.04984 Da |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C=CC2=CC=CC=C2Cl |
| InChIKey | IGSYOTSSTZUGIA-UHFFFAOYSA-N |
Chemical Property Profile of Chlorochalcone
Property Insights of Chlorochalcone
The XLogP value of 4.4 indicates that Chlorochalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Chlorochalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorochalcone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Chlorochalcone?
The CAS number of Chlorochalcone is 22966-11-6.
What is the molecular formula of Chlorochalcone?
The molecular formula of Chlorochalcone is C15H11ClO.
What is the molecular weight of Chlorochalcone?
The molecular weight of Chlorochalcone is 242.04984 g/mol.
Where can I buy Chlorochalcone?
You can request a quote for Chlorochalcone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chlorochalcone?
Yes, CoreyChem provides custom synthesis services for Chlorochalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.