Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate
TL;DR: Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate (CAS 139266-54-9) is a chemical compound with molecular formula C14H11Br3O5 and molecular weight 495.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-bromo-2-[2,4-dibromo-5-(4-methoxyphenyl)-3-oxofuran-2-yl]acetate
Also Known As: Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate, 2-Furanacetic acid, 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-, methyl ester, methyl 2-bromo-2-[2,4-dibromo-5-(4-methoxyphenyl)-3-oxo-2-furyl]acetate, methyl 2-bromo-2-[2,4-dibromo-5-(4-methoxyphenyl)-3-oxofuran-2-yl]acetate, methyl 2-bromo-2-[2,4-dibromo-5-(4-methoxyphenyl)-3-oxo-2-furyl]acetat e
| Molecular Formula | C14H11Br3O5 |
|---|---|
| Molecular Weight | 495.82 g/mol |
| LogP | 3.3857 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 495.81567 |
| Heavy Atoms | 22 |
| Complexity | 640.3833 |
Chemical Identifiers
| CAS Number | 139266-54-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=O)C(O2)(C(C(=O)OC)Br)Br)Br |
Product Overview
Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate (CAS 139266-54-9), with molecular formula C14H11Br3O5 and molecular weight 495.82 g/mol. IUPAC: methyl 2-bromo-2-[2,4-dibromo-5-(4-methoxyphenyl)-3-oxofuran-2-yl]acetate.
Chemical Property Profile of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate
Property Insights of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate
The XLogP value of 3.3857 indicates that Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate. Following Lipinski's Rule of Five, Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate has 0 hydrogen bond donor(s) and 5 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 Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate?
The CAS number of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate is 139266-54-9.
What is the molecular formula of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate?
The molecular formula of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate is C14H11Br3O5.
What is the molecular weight of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate?
The molecular weight of Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate is 495.82 g/mol.
Where can I buy Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate?
You can request a quote for Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,3-dihydro-5-(4-methoxyphenyl)-3-oxo-alpha,2,4-tribromo-2-furanacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.