4-Bromobenzaldehyde
TL;DR: 4-Bromobenzaldehyde (CAS 1122-91-4) is a chemical compound with molecular formula C7H5BrO and molecular weight 183.95238 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromobenzaldehyde
Also Known As: 4-Bromobenzaldehyde, p-Bromobenzaldehyde, Benzaldehyde, 4-bromo-, Benzaldehyde, p-bromo-, null
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H5BrO |
| Molecular Weight | 183.95238 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.95238 Da |
| Heavy Atoms | 9 |
| Complexity | 95.0 |
| SMILES | C1=CC(=CC=C1C=O)Br |
| InChIKey | ZRYZBQLXDKPBDU-UHFFFAOYSA-N |
Chemical Property Profile of 4-Bromobenzaldehyde
Property Insights of 4-Bromobenzaldehyde
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromobenzaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Bromobenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromobenzaldehyde 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 4-Bromobenzaldehyde?
The CAS number of 4-Bromobenzaldehyde is 1122-91-4.
What is the molecular formula of 4-Bromobenzaldehyde?
The molecular formula of 4-Bromobenzaldehyde is C7H5BrO.
What is the molecular weight of 4-Bromobenzaldehyde?
The molecular weight of 4-Bromobenzaldehyde is 183.95238 g/mol.
Where can I buy 4-Bromobenzaldehyde?
You can request a quote for 4-Bromobenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromobenzaldehyde?
Yes, CoreyChem provides custom synthesis services for 4-Bromobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.