2-Bromobenzyl 3,3,3-trifluoropropyl ether
TL;DR: 2-Bromobenzyl 3,3,3-trifluoropropyl ether (CAS 500875-27-4) is a chemical compound with molecular formula C10H10BrF3O and molecular weight 281.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-(3,3,3-trifluoropropoxymethyl)benzene
Also Known As: 2-Bromobenzyl 3,3,3-trifluoropropyl ether, 1-bromo-2-(3,3,3-trifluoropropoxymethyl)benzene, 1-bromo-2-((3,3,3-trifluoropropoxy)methyl)benzene
| Molecular Formula | C10H10BrF3O |
|---|---|
| Molecular Weight | 281.99 g/mol |
| LogP | 3.9181 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.98672 |
| Heavy Atoms | 15 |
| Complexity | 311.78098 |
Chemical Identifiers
| CAS Number | 500875-27-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COCCC(F)(F)F)Br |
Product Overview
2-Bromobenzyl 3,3,3-trifluoropropyl ether (CAS 500875-27-4), with molecular formula C10H10BrF3O and molecular weight 281.99 g/mol. IUPAC: 1-bromo-2-(3,3,3-trifluoropropoxymethyl)benzene.
Chemical Property Profile of 2-Bromobenzyl 3,3,3-trifluoropropyl ether
Property Insights of 2-Bromobenzyl 3,3,3-trifluoropropyl ether
The XLogP value of 3.9181 indicates that 2-Bromobenzyl 3,3,3-trifluoropropyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 2-Bromobenzyl 3,3,3-trifluoropropyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromobenzyl 3,3,3-trifluoropropyl ether 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 2-Bromobenzyl 3,3,3-trifluoropropyl ether?
The CAS number of 2-Bromobenzyl 3,3,3-trifluoropropyl ether is 500875-27-4.
What is the molecular formula of 2-Bromobenzyl 3,3,3-trifluoropropyl ether?
The molecular formula of 2-Bromobenzyl 3,3,3-trifluoropropyl ether is C10H10BrF3O.
What is the molecular weight of 2-Bromobenzyl 3,3,3-trifluoropropyl ether?
The molecular weight of 2-Bromobenzyl 3,3,3-trifluoropropyl ether is 281.99 g/mol.
Where can I buy 2-Bromobenzyl 3,3,3-trifluoropropyl ether?
You can request a quote for 2-Bromobenzyl 3,3,3-trifluoropropyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromobenzyl 3,3,3-trifluoropropyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromobenzyl 3,3,3-trifluoropropyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.