4-Bromo-2,3,6-trifluorobenzaldehyde
TL;DR: 4-Bromo-2,3,6-trifluorobenzaldehyde (CAS 252004-34-5) is a chemical compound with molecular formula C7H2BrF3O and molecular weight 237.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2,3,6-trifluorobenzaldehyde
Also Known As: 4-bromo-2,3,6-trifluorobenzaldehyde, Benzaldehyde, 4-bromo-2,3,6-trifluoro-, 4-bromo-2,3,6-trifluoro-benzaldehyde, S-8114, 4-Bromo-2 pound not3 pound not6-trifluorobenzaldehyde
| Molecular Formula | C7H2BrF3O |
|---|---|
| Molecular Weight | 237.92 g/mol |
| LogP | 2.6789 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.9241 |
| Heavy Atoms | 12 |
| Complexity | 337.91364 |
Chemical Identifiers
| CAS Number | 252004-34-5 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)F)F)C=O)F |
Product Overview
4-Bromo-2,3,6-trifluorobenzaldehyde (CAS 252004-34-5), with molecular formula C7H2BrF3O and molecular weight 237.92 g/mol. IUPAC: 4-bromo-2,3,6-trifluorobenzaldehyde.
Chemical Property Profile of 4-Bromo-2,3,6-trifluorobenzaldehyde
Property Insights of 4-Bromo-2,3,6-trifluorobenzaldehyde
The XLogP value of 2.6789 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2,3,6-trifluorobenzaldehyde. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Bromo-2,3,6-trifluorobenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2,3,6-trifluorobenzaldehyde 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
Frequently Asked Questions
What is the CAS number of 4-Bromo-2,3,6-trifluorobenzaldehyde?
The CAS number of 4-Bromo-2,3,6-trifluorobenzaldehyde is 252004-34-5.
What is the molecular formula of 4-Bromo-2,3,6-trifluorobenzaldehyde?
The molecular formula of 4-Bromo-2,3,6-trifluorobenzaldehyde is C7H2BrF3O.
What is the molecular weight of 4-Bromo-2,3,6-trifluorobenzaldehyde?
The molecular weight of 4-Bromo-2,3,6-trifluorobenzaldehyde is 237.92 g/mol.
Where can I buy 4-Bromo-2,3,6-trifluorobenzaldehyde?
You can request a quote for 4-Bromo-2,3,6-trifluorobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2,3,6-trifluorobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2,3,6-trifluorobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.