Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate
TL;DR: Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate (CAS 308295-60-5) is a chemical compound with molecular formula C18H12BrClO5 and molecular weight 421.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-bromo-5-(4-chlorobenzoyl)oxy-2-methyl-1-benzofuran-3-carboxylate
Also Known As: ChemDiv1_006290, METHYL 6-BROMO-5-(4-CHLOROBENZOYLOXY)-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE, 6-bromo-3-(methoxycarbonyl)-2-methylbenzo[b]furan-5-yl 4-chlorobenzoate, F0821-0342, methyl 6-bromo-5-((4-chlorobenzoyl)oxy)-2-methylbenzofuran-3-carboxylate
| Molecular Formula | C18H12BrClO5 |
|---|---|
| Molecular Weight | 421.96 g/mol |
| LogP | 5.16292 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.95566 |
| Heavy Atoms | 25 |
| Complexity | 975.2903 |
Chemical Identifiers
| CAS Number | 308295-60-5 |
|---|---|
| SMILES | CC1=C(C2=CC(=C(C=C2O1)Br)OC(=O)C3=CC=C(C=C3)Cl)C(=O)OC |
Product Overview
Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate (CAS 308295-60-5), with molecular formula C18H12BrClO5 and molecular weight 421.96 g/mol. IUPAC: methyl 6-bromo-5-(4-chlorobenzoyl)oxy-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate
Property Insights of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate
The XLogP value of 5.16292 indicates that Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate. Following Lipinski's Rule of Five, Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate 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 Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate?
The CAS number of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate is 308295-60-5.
What is the molecular formula of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate?
The molecular formula of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate is C18H12BrClO5.
What is the molecular weight of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate?
The molecular weight of Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate is 421.96 g/mol.
Where can I buy Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate?
You can request a quote for Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 6-bromo-5-(4-chlorobenzoyloxy)-2-methyl-1-benzofuran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.