2,2,2-Tribromoethyl furan-2-carboxylate
TL;DR: 2,2,2-Tribromoethyl furan-2-carboxylate (CAS 63938-47-6) is a chemical compound with molecular formula C7H5Br3O3 and molecular weight 373.77887 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,2-tribromoethyl furan-2-carboxylate
Also Known As: Tribromoethyl 2-furoate, 2,2,2-tribromoethyl 2-furoate, 2,2,2-tribromoethyl furan-2-carboxylate, 2-Furoic acid, ester with tribromoethanol, 2-Furoic acid, 2,2,2-tribromoethyl ester
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H5Br3O3 |
| Molecular Weight | 373.77887 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.77682 Da |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
| SMILES | C1=COC(=C1)C(=O)OCC(Br)(Br)Br |
| InChIKey | CKCVDRMAADONAQ-UHFFFAOYSA-N |
Chemical Property Profile of 2,2,2-Tribromoethyl furan-2-carboxylate
Property Insights of 2,2,2-Tribromoethyl furan-2-carboxylate
The XLogP value of 3.5 indicates that 2,2,2-Tribromoethyl furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, 2,2,2-Tribromoethyl furan-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-Tribromoethyl furan-2-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,2,2-Tribromoethyl furan-2-carboxylate?
The CAS number of 2,2,2-Tribromoethyl furan-2-carboxylate is 63938-47-6.
What is the molecular formula of 2,2,2-Tribromoethyl furan-2-carboxylate?
The molecular formula of 2,2,2-Tribromoethyl furan-2-carboxylate is C7H5Br3O3.
What is the molecular weight of 2,2,2-Tribromoethyl furan-2-carboxylate?
The molecular weight of 2,2,2-Tribromoethyl furan-2-carboxylate is 373.77887 g/mol.
Where can I buy 2,2,2-Tribromoethyl furan-2-carboxylate?
You can request a quote for 2,2,2-Tribromoethyl furan-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2,2-Tribromoethyl furan-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for 2,2,2-Tribromoethyl furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.