3-(2-Bromoethyl)furan
TL;DR: 3-(2-Bromoethyl)furan (CAS 98126-46-6) is a chemical compound with molecular formula C6H7BrO and molecular weight 173.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-bromoethyl)furan
Also Known As: 3-(2-bromoethyl)furan, furan, 3-(2-bromoethyl)-, 2-(3-furyl)ethyl bromide, J1.298.642D, RefChem:273580
| Molecular Formula | C6H7BrO |
|---|---|
| Molecular Weight | 173.97 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.96803 |
| Heavy Atoms | 8 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 98126-46-6 |
|---|---|
| SMILES | C1=COC=C1CCBr |
| InChIKey | ORNSEMITWVIZSU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Bromoethyl)furan (CAS 98126-46-6), with molecular formula C6H7BrO and molecular weight 173.97 g/mol. IUPAC: 3-(2-bromoethyl)furan.
Chemical Property Profile of 3-(2-Bromoethyl)furan
Property Insights of 3-(2-Bromoethyl)furan
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Bromoethyl)furan. With a topological polar surface area (TPSA) of 13.1 Ų, 3-(2-Bromoethyl)furan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Bromoethyl)furan 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 3-(2-Bromoethyl)furan?
The CAS number of 3-(2-Bromoethyl)furan is 98126-46-6.
What is the molecular formula of 3-(2-Bromoethyl)furan?
The molecular formula of 3-(2-Bromoethyl)furan is C6H7BrO.
What is the molecular weight of 3-(2-Bromoethyl)furan?
The molecular weight of 3-(2-Bromoethyl)furan is 173.97 g/mol.
Where can I buy 3-(2-Bromoethyl)furan?
You can request a quote for 3-(2-Bromoethyl)furan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Bromoethyl)furan?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Bromoethyl)furan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.