5-Bromo-4-(chloromethyl)-5h-furan-2-one
TL;DR: 5-Bromo-4-(chloromethyl)-5h-furan-2-one (CAS 125974-02-9) is a chemical compound with molecular formula C5H4BrClO2 and molecular weight 209.90833 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-3-(chloromethyl)-2H-furan-5-one
Also Known As: C5-H$-Br-Cl-O2, 5-bromo-4-(chloromethyl)-5h-furan-2-one, 2-bromo-3-(chloromethyl)-2H-furan-5-one, 4-(Chloromethyl)-5-bromofuran-2(5H)-one, 5-Bromo-4-(chloromethyl)-2(5H)-furanone
Technical Specifications
| Molecular Formula | C5H4BrClO2 |
| Molecular Weight | 209.90833 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.90833 Da |
| Heavy Atoms | 9 |
| Complexity | 166.0 |
| SMILES | C1=C(C(OC1=O)Br)CCl |
| InChIKey | APQPIVWGQHTRLX-UHFFFAOYSA-N |
Chemical Property Profile of 5-Bromo-4-(chloromethyl)-5h-furan-2-one
Property Insights of 5-Bromo-4-(chloromethyl)-5h-furan-2-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-4-(chloromethyl)-5h-furan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Bromo-4-(chloromethyl)-5h-furan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-4-(chloromethyl)-5h-furan-2-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
What is the CAS number of 5-Bromo-4-(chloromethyl)-5h-furan-2-one?
The CAS number of 5-Bromo-4-(chloromethyl)-5h-furan-2-one is 125974-02-9.
What is the molecular formula of 5-Bromo-4-(chloromethyl)-5h-furan-2-one?
The molecular formula of 5-Bromo-4-(chloromethyl)-5h-furan-2-one is C5H4BrClO2.
What is the molecular weight of 5-Bromo-4-(chloromethyl)-5h-furan-2-one?
The molecular weight of 5-Bromo-4-(chloromethyl)-5h-furan-2-one is 209.90833 g/mol.
Where can I buy 5-Bromo-4-(chloromethyl)-5h-furan-2-one?
You can request a quote for 5-Bromo-4-(chloromethyl)-5h-furan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Bromo-4-(chloromethyl)-5h-furan-2-one?
Yes, CoreyChem provides custom synthesis services for 5-Bromo-4-(chloromethyl)-5h-furan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.