![1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene structure](/static/products/2252/2252-45-1.webp)
1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene
TL;DR: 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene (CAS 2252-45-1) is a chemical compound with molecular formula C7H4BrF3S and molecular weight 255.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-(trifluoromethylsulfanyl)benzene
Also Known As: (3-Bromophenyl)(trifluoromethyl)sulfane, 3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE, 3-Bromophenyl trifluoromethyl sulfide, 3- BROMOBENZENE, 3-trifluoromethylthio-1-bromobenzene
| Molecular Formula | C7H4BrF3S |
|---|---|
| Molecular Weight | 255.92 g/mol |
| LogP | 4.061 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.91692 |
| Heavy Atoms | 12 |
| Complexity | 271.59915 |
Chemical Identifiers
| CAS Number | 2252-45-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)SC(F)(F)F |
Product Overview
1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene (CAS 2252-45-1), with molecular formula C7H4BrF3S and molecular weight 255.92 g/mol. IUPAC: 1-bromo-3-(trifluoromethylsulfanyl)benzene.
Chemical Property Profile of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene
Property Insights of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene
The XLogP value of 4.061 indicates that 1-Bromo-3-[(trifluoromethyl)sulfanyl]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-Bromo-3-[(trifluoromethyl)sulfanyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene 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 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene?
The CAS number of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene is 2252-45-1.
What is the molecular formula of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene?
The molecular formula of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene is C7H4BrF3S.
What is the molecular weight of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene?
The molecular weight of 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene is 255.92 g/mol.
Where can I buy 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene?
You can request a quote for 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-3-[(trifluoromethyl)sulfanyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.