3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate
TL;DR: 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate (CAS 63031-47-0) is a chemical compound with molecular formula C11H6Cl2O4 and molecular weight 271.96432 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4-dichloro-5-oxo-2H-furan-2-yl) benzoate
Also Known As: (3,4-dichloro-5-oxo-2H-furan-2-yl) Benzoate, 3,4-dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate, 2(5H)-Furanone, 5-(benzoyloxy)-3,4-dichloro-, 3,4-DICHLORO-5-OXO-2,5-DIHYDRO-2-FURANYL BENZOATE
Technical Specifications
| Molecular Formula | C11H6Cl2O4 |
| Molecular Weight | 271.96432 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.96432 Da |
| Heavy Atoms | 17 |
| Complexity | 372.0 |
| SMILES | C1=CC=C(C=C1)C(=O)OC2C(=C(C(=O)O2)Cl)Cl |
| InChIKey | YOVVGTXLYNLCGZ-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate
Property Insights of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate
The XLogP value of 3.1 indicates that 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate?
The CAS number of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate is 63031-47-0.
What is the molecular formula of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate?
The molecular formula of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate is C11H6Cl2O4.
What is the molecular weight of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate?
The molecular weight of 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate is 271.96432 g/mol.
Where can I buy 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate?
You can request a quote for 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate?
Yes, CoreyChem provides custom synthesis services for 3,4-Dichloro-5-oxo-2,5-dihydrofuran-2-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.