3-Bromo-4-fluorobenzaldehyde
TL;DR: 3-Bromo-4-fluorobenzaldehyde (CAS 94569-84-3) is a chemical compound with molecular formula C7H4BrFO and molecular weight 201.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-fluorobenzaldehyde
Also Known As: 3-Bromo-4-fluorobenzaldehyde, 4-Fluoro-3-bromobenzaldehyde, null, Benzaldehyde, 3-bromo-4-fluoro-, 3-Bromo-fluorobenzyldehyde
| Molecular Formula | C7H4BrFO |
|---|---|
| Molecular Weight | 201.94 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.94296 |
| Heavy Atoms | 10 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 94569-84-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=O)Br)F |
| InChIKey | FAHZIKXYYRGSHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromo-4-fluorobenzaldehyde (CAS 94569-84-3), with molecular formula C7H4BrFO and molecular weight 201.94 g/mol. IUPAC: 3-bromo-4-fluorobenzaldehyde.
Chemical Property Profile of 3-Bromo-4-fluorobenzaldehyde
Property Insights of 3-Bromo-4-fluorobenzaldehyde
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-4-fluorobenzaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Bromo-4-fluorobenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-4-fluorobenzaldehyde has 0 hydrogen bond donor(s) and 2 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 3-Bromo-4-fluorobenzaldehyde?
The CAS number of 3-Bromo-4-fluorobenzaldehyde is 94569-84-3.
What is the molecular formula of 3-Bromo-4-fluorobenzaldehyde?
The molecular formula of 3-Bromo-4-fluorobenzaldehyde is C7H4BrFO.
What is the molecular weight of 3-Bromo-4-fluorobenzaldehyde?
The molecular weight of 3-Bromo-4-fluorobenzaldehyde is 201.94 g/mol.
Where can I buy 3-Bromo-4-fluorobenzaldehyde?
You can request a quote for 3-Bromo-4-fluorobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-4-fluorobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-4-fluorobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.