3-Chlorobenzophenone
TL;DR: 3-Chlorobenzophenone (CAS 1016-78-0) is a chemical compound with molecular formula C13H9ClO and molecular weight 216.0342 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-chlorophenyl)-phenylmethanone
Also Known As: 3-Chlorobenzophenone, (3-Chlorophenyl)(phenyl)methanone, m-Chlorobenzophenone, Methanone, (3-chlorophenyl)phenyl-, Benzophenone, 3-chloro-
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H9ClO |
| Molecular Weight | 216.0342 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.0342 Da |
| Heavy Atoms | 15 |
| Complexity | 221.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)Cl |
| InChIKey | CPLWKNRPZVNELG-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chlorobenzophenone
Property Insights of 3-Chlorobenzophenone
The XLogP value of 4.2 indicates that 3-Chlorobenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Chlorobenzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chlorobenzophenone 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 3-Chlorobenzophenone?
The CAS number of 3-Chlorobenzophenone is 1016-78-0.
What is the molecular formula of 3-Chlorobenzophenone?
The molecular formula of 3-Chlorobenzophenone is C13H9ClO.
What is the molecular weight of 3-Chlorobenzophenone?
The molecular weight of 3-Chlorobenzophenone is 216.0342 g/mol.
Where can I buy 3-Chlorobenzophenone?
You can request a quote for 3-Chlorobenzophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chlorobenzophenone?
Yes, CoreyChem provides custom synthesis services for 3-Chlorobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.