5-Bromodihydrofuran-2(3H)-one
TL;DR: 5-Bromodihydrofuran-2(3H)-one (CAS 94386-29-5) is a chemical compound with molecular formula C4H5BrO2 and molecular weight 163.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromooxolan-2-one
Also Known As: 5-bromooxolan-2-one, 5-Bromodihydrofuran-2(3H)-one, 5-bromodihydrofuran-2 -one, 4-bromo-gamma-butyrolactone, EINECS 305-251-2
| Molecular Formula | C4H5BrO2 |
|---|---|
| Molecular Weight | 163.95 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.9473 |
| Heavy Atoms | 7 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 94386-29-5 |
|---|---|
| SMILES | C1CC(=O)OC1Br |
| InChIKey | SRXYQTZEGZGPCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Bromodihydrofuran-2(3H)-one (CAS 94386-29-5), with molecular formula C4H5BrO2 and molecular weight 163.95 g/mol. IUPAC: 5-bromooxolan-2-one.
Chemical Property Profile of 5-Bromodihydrofuran-2(3H)-one
Property Insights of 5-Bromodihydrofuran-2(3H)-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromodihydrofuran-2(3H)-one. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Bromodihydrofuran-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromodihydrofuran-2(3H)-one has 0 hydrogen bond donor(s) and 2 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 5-Bromodihydrofuran-2(3H)-one?
The CAS number of 5-Bromodihydrofuran-2(3H)-one is 94386-29-5.
What is the molecular formula of 5-Bromodihydrofuran-2(3H)-one?
The molecular formula of 5-Bromodihydrofuran-2(3H)-one is C4H5BrO2.
What is the molecular weight of 5-Bromodihydrofuran-2(3H)-one?
The molecular weight of 5-Bromodihydrofuran-2(3H)-one is 163.95 g/mol.
Where can I buy 5-Bromodihydrofuran-2(3H)-one?
You can request a quote for 5-Bromodihydrofuran-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromodihydrofuran-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromodihydrofuran-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.