(3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate
TL;DR: (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate (CAS 14032-73-6) is a chemical compound with molecular formula C11H6Br2O4 and molecular weight 359.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate
Also Known As: (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate, 5-(Benzoyloxy)-3,4-dibromo-2(5H)-furanone, 2(5H)-Furanone, 5-(benzoyloxy)-3,4-dibromo-, AI-559/11193088, 3,4-dibromo-5-oxo-2,5-dihydro-2-furanyl benzoate
| Molecular Formula | C11H6Br2O4 |
|---|---|
| Molecular Weight | 359.86 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 359.86328 |
| Heavy Atoms | 17 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 14032-73-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2C(=C(C(=O)O2)Br)Br |
| InChIKey | ZVYNVALWEVDUSF-UHFFFAOYSA-N |
Product Overview
(3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate (CAS 14032-73-6), with molecular formula C11H6Br2O4 and molecular weight 359.86 g/mol. IUPAC: (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate.
Chemical Property Profile of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate
Property Insights of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate
The XLogP value of 3.2 indicates that (3,4-dibromo-5-oxo-2H-furan-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-dibromo-5-oxo-2H-furan-2-yl) benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-dibromo-5-oxo-2H-furan-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
Frequently Asked Questions
What is the CAS number of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate?
The CAS number of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate is 14032-73-6.
What is the molecular formula of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate?
The molecular formula of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate is C11H6Br2O4.
What is the molecular weight of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate?
The molecular weight of (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate is 359.86 g/mol.
Where can I buy (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate?
You can request a quote for (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-dibromo-5-oxo-2H-furan-2-yl) benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.