2',6'-Dibromo-4'-(trifluoromethyl)acetanilide
TL;DR: 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide (CAS 544716-06-5) is a chemical compound with molecular formula C9H6Br2F3NO and molecular weight 358.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,6-dibromo-4-(trifluoromethyl)phenyl]acetamide
Also Known As: 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide, N-[2,6-dibromo-4-(trifluoromethyl)phenyl]acetamide, 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide, 98%, C9H6Br2F3NO
| Molecular Formula | C9H6Br2F3NO |
|---|---|
| Molecular Weight | 358.88 g/mol |
| LogP | 4.1888 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 358.87683 |
| Heavy Atoms | 16 |
| Complexity | 408.24765 |
Chemical Identifiers
| CAS Number | 544716-06-5 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1Br)C(F)(F)F)Br |
Product Overview
2',6'-Dibromo-4'-(trifluoromethyl)acetanilide (CAS 544716-06-5), with molecular formula C9H6Br2F3NO and molecular weight 358.88 g/mol. IUPAC: N-[2,6-dibromo-4-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide
Property Insights of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide
The XLogP value of 4.1888 indicates that 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide 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 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide?
The CAS number of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide is 544716-06-5.
What is the molecular formula of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide?
The molecular formula of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide is C9H6Br2F3NO.
What is the molecular weight of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide?
The molecular weight of 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide is 358.88 g/mol.
Where can I buy 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide?
You can request a quote for 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide?
Yes, KEHONG BIO provides custom synthesis services for 2',6'-Dibromo-4'-(trifluoromethyl)acetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.