4-Bromobenzamide
TL;DR: 4-Bromobenzamide (CAS 698-67-9) is a chemical compound with molecular formula C7H6BrNO and molecular weight 198.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromobenzamide
Also Known As: 4-Bromobenzamide, p-Bromobenzamide, Benzamide, 4-bromo-, Benzamide, p-bromo-, 4-Bromo-benzamide
| Molecular Formula | C7H6BrNO |
|---|---|
| Molecular Weight | 198.96 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.96329 |
| Heavy Atoms | 10 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 698-67-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)N)Br |
| InChIKey | ZRWNRAJCPNLYAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromobenzamide (CAS 698-67-9), with molecular formula C7H6BrNO and molecular weight 198.96 g/mol. IUPAC: 4-bromobenzamide.
Chemical Property Profile of 4-Bromobenzamide
Property Insights of 4-Bromobenzamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromobenzamide. With a topological polar surface area (TPSA) of 43.1 Ų, 4-Bromobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-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
Frequently Asked Questions
What is the CAS number of 4-Bromobenzamide?
The CAS number of 4-Bromobenzamide is 698-67-9.
What is the molecular formula of 4-Bromobenzamide?
The molecular formula of 4-Bromobenzamide is C7H6BrNO.
What is the molecular weight of 4-Bromobenzamide?
The molecular weight of 4-Bromobenzamide is 198.96 g/mol.
Where can I buy 4-Bromobenzamide?
You can request a quote for 4-Bromobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.