1,4-Dibromo-2-(trifluoromethyl)benzene
TL;DR: 1,4-Dibromo-2-(trifluoromethyl)benzene (CAS 7657-09-2) is a chemical compound with molecular formula C7H3Br2F3 and molecular weight 301.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dibromo-2-(trifluoromethyl)benzene
Also Known As: 2,5-Dibromobenzotrifluoride, 1,4-Dibromo-2-(trifluoromethyl)benzene, 2,5-Dibromobenzotrifloride, NCIOpen2_009660, 1,4-Bibromo-2-(trifluoromethyl)benzene
| Molecular Formula | C7H3Br2F3 |
|---|---|
| Molecular Weight | 301.86 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 303.8533 |
| Heavy Atoms | 12 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 7657-09-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)C(F)(F)F)Br |
| InChIKey | VWKFJAOCLPPQGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dibromo-2-(trifluoromethyl)benzene (CAS 7657-09-2), with molecular formula C7H3Br2F3 and molecular weight 301.86 g/mol. IUPAC: 1,4-dibromo-2-(trifluoromethyl)benzene.
Chemical Property Profile of 1,4-Dibromo-2-(trifluoromethyl)benzene
Property Insights of 1,4-Dibromo-2-(trifluoromethyl)benzene
The XLogP value of 4.2 indicates that 1,4-Dibromo-2-(trifluoromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4-Dibromo-2-(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dibromo-2-(trifluoromethyl)benzene has 0 hydrogen bond donor(s) and 3 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 1,4-Dibromo-2-(trifluoromethyl)benzene?
The CAS number of 1,4-Dibromo-2-(trifluoromethyl)benzene is 7657-09-2.
What is the molecular formula of 1,4-Dibromo-2-(trifluoromethyl)benzene?
The molecular formula of 1,4-Dibromo-2-(trifluoromethyl)benzene is C7H3Br2F3.
What is the molecular weight of 1,4-Dibromo-2-(trifluoromethyl)benzene?
The molecular weight of 1,4-Dibromo-2-(trifluoromethyl)benzene is 301.86 g/mol.
Where can I buy 1,4-Dibromo-2-(trifluoromethyl)benzene?
You can request a quote for 1,4-Dibromo-2-(trifluoromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dibromo-2-(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dibromo-2-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.