![[2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate structure](/static/products/5528/5528-13-2.webp)
[2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate
TL;DR: [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate (CAS 5528-13-2) is a chemical compound with molecular formula C13H8BrNO6 and molecular weight 352.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate
Also Known As: BAS 00397155, 2-(4-NITROPHENYL)-2-OXOETHYL 5-BROMO-2-FUROATE, [2-(4-nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate, AB00087470-01, 2-(4-nitrophenyl)-2-oxoethyl 5-bromofuran-2-carboxylate
| Molecular Formula | C13H8BrNO6 |
|---|---|
| Molecular Weight | 352.95 g/mol |
| LogP | 2.99 |
| Topological Polar Surface Area | 99.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.9535 |
| Heavy Atoms | 21 |
| Complexity | 690.94196 |
Chemical Identifiers
| CAS Number | 5528-13-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)COC(=O)C2=CC=C(O2)Br)[N+](=O)[O-] |
Product Overview
[2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate (CAS 5528-13-2), with molecular formula C13H8BrNO6 and molecular weight 352.95 g/mol. IUPAC: [2-(4-nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate.
Chemical Property Profile of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate
Property Insights of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate
The XLogP value of 2.99 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate. The TPSA of 99.65 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate. Following Lipinski's Rule of Five, [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate has 0 hydrogen bond donor(s) and 6 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 [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate?
The CAS number of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate is 5528-13-2.
What is the molecular formula of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate?
The molecular formula of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate is C13H8BrNO6.
What is the molecular weight of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate?
The molecular weight of [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate is 352.95 g/mol.
Where can I buy [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate?
You can request a quote for [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Nitrophenyl)-2-oxoethyl] 5-bromofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.