(Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate
TL;DR: (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate (CAS 862244-73-3) is a chemical compound with molecular formula C24H15BrO6 and molecular weight 478.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(Z)-[6-(4-bromobenzoyl)oxy-3-oxo-1-benzofuran-2-ylidene]methyl]benzoate
Also Known As: (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate, 2-{[4-(methoxycarbonyl)phenyl]methylene}-3-oxobenzo[3,4-b]furan-6-yl 4-bromobe nzoate, methyl 4-[(Z)-[6-(4-bromobenzoyl)oxy-3-oxo-1-benzofuran-2-ylidene]methyl]benzoate, Methyl 4-[[6-(4-bromobenzoyl)oxy-3-oxo-benzofuran-2-ylidene]methyl]benzoate, (2Z)-2-[4-(methoxycarbonyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-bromobenzoate
| Molecular Formula | C24H15BrO6 |
|---|---|
| Molecular Weight | 478.01 g/mol |
| LogP | 5.0711 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 478.0052 |
| Heavy Atoms | 31 |
| Complexity | 1209.8219 |
Chemical Identifiers
| CAS Number | 862244-73-3 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br |
Product Overview
(Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate (CAS 862244-73-3), with molecular formula C24H15BrO6 and molecular weight 478.01 g/mol. IUPAC: methyl 4-[(Z)-[6-(4-bromobenzoyl)oxy-3-oxo-1-benzofuran-2-ylidene]methyl]benzoate.
Chemical Property Profile of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate
Property Insights of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate
The XLogP value of 5.0711 indicates that (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate. Following Lipinski's Rule of Five, (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate?
The CAS number of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate is 862244-73-3.
What is the molecular formula of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate?
The molecular formula of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate is C24H15BrO6.
What is the molecular weight of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate?
The molecular weight of (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate is 478.01 g/mol.
Where can I buy (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate?
You can request a quote for (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(4-(methoxycarbonyl)benzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.