3-Bromobenzamide
TL;DR: 3-Bromobenzamide (CAS 22726-00-7) is a chemical compound with molecular formula C7H6BrNO and molecular weight 198.96329 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromobenzamide
Also Known As: 3-Bromobenzamide, m-Bromobenzamide, Benzamide, 3-bromo-, Benzamide, m-bromo-, 3-Bromo-benzamide
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H6BrNO |
| Molecular Weight | 198.96329 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.96329 Da |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
| SMILES | C1=CC(=CC(=C1)Br)C(=O)N |
| InChIKey | ODJFDWIECLJWSR-UHFFFAOYSA-N |
Chemical Property Profile of 3-Bromobenzamide
Property Insights of 3-Bromobenzamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromobenzamide. With a topological polar surface area (TPSA) of 43.1 Ų, 3-Bromobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromobenzamide has 1 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-Bromobenzamide?
The CAS number of 3-Bromobenzamide is 22726-00-7.
What is the molecular formula of 3-Bromobenzamide?
The molecular formula of 3-Bromobenzamide is C7H6BrNO.
What is the molecular weight of 3-Bromobenzamide?
The molecular weight of 3-Bromobenzamide is 198.96329 g/mol.
Where can I buy 3-Bromobenzamide?
You can request a quote for 3-Bromobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Bromobenzamide?
Yes, CoreyChem provides custom synthesis services for 3-Bromobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.