4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate
TL;DR: 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate (CAS 1048-37-9) is a chemical compound with molecular formula C24H14Br4O5 and molecular weight 697.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(4-acetyloxy-3,5-dibromophenyl)-2-benzofuran-1-yl]-2,6-dibromophenyl] acetate
Also Known As: 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate, (2-Benzofuran-1,3-diyl)bis(2,6-dibromo-4,1-phenylene) diacetate, Phenol, 4,4'-(1,3-isobenzofurandiyl)bis[2,6-dibromo-, diacetate, Phenol,4,4'-(1,3-isobenzofurandiyl)bis[2,6-dibromo-, diacetate (8CI), [4-[3-(4-acetoxy-3,5-dibromo-phenyl)isobenzofuran-1-yl]-2,6-dibromo-phenyl] acetate
| Molecular Formula | C24H14Br4O5 |
|---|---|
| Molecular Weight | 697.76 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 697.75745 |
| Heavy Atoms | 33 |
| Complexity | 641.0 |
Chemical Identifiers
| CAS Number | 1048-37-9 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1Br)C2=C3C=CC=CC3=C(O2)C4=CC(=C(C(=C4)Br)OC(=O)C)Br)Br |
| InChIKey | XQPQPCFSXLNIKA-UHFFFAOYSA-N |
Product Overview
4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate (CAS 1048-37-9), with molecular formula C24H14Br4O5 and molecular weight 697.76 g/mol. IUPAC: [4-[3-(4-acetyloxy-3,5-dibromophenyl)-2-benzofuran-1-yl]-2,6-dibromophenyl] acetate.
Chemical Property Profile of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate
Property Insights of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate
The XLogP value of 7.8 indicates that 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate. Following Lipinski's Rule of Five, 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate?
The CAS number of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate is 1048-37-9.
What is the molecular formula of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate?
The molecular formula of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate is C24H14Br4O5.
What is the molecular weight of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate?
The molecular weight of 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate is 697.76 g/mol.
Where can I buy 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate?
You can request a quote for 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-(4-(Acetyloxy)-3,5-dibromophenyl)-2-benzofuran-1-yl)-2,6-dibromophenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.