4-methyl-3-(4-nitrophenyl)-2(5H)-furanone
TL;DR: 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone (CAS 7692-92-4) is a chemical compound with molecular formula C11H9NO4 and molecular weight 219.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-(4-nitrophenyl)-2H-furan-5-one
Also Known As: 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone, 4-methyl-3-(4-nitrophenyl)-2,5-dihydrofuran-2-one, 3-methyl-4-(4-nitrophenyl)-2H-furan-5-one, 4-methyl-3-(4-nitrophenyl)-5H-furan-2-one, 4-methyl-3-(4-nitro-phenyl)-5H-furan-2-one
| Molecular Formula | C11H9NO4 |
|---|---|
| Molecular Weight | 219.05 g/mol |
| LogP | 1.9251 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.05316 |
| Heavy Atoms | 16 |
| Complexity | 487.21097 |
Chemical Identifiers
| CAS Number | 7692-92-4 |
|---|---|
| SMILES | CC1=C(C(=O)OC1)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
4-methyl-3-(4-nitrophenyl)-2(5H)-furanone (CAS 7692-92-4), with molecular formula C11H9NO4 and molecular weight 219.05 g/mol. IUPAC: 3-methyl-4-(4-nitrophenyl)-2H-furan-5-one.
Chemical Property Profile of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone
Property Insights of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone
The XLogP value of 1.9251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone. Following Lipinski's Rule of Five, 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone has 0 hydrogen bond donor(s) and 4 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 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone?
The CAS number of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone is 7692-92-4.
What is the molecular formula of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone?
The molecular formula of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone is C11H9NO4.
What is the molecular weight of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone?
The molecular weight of 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone is 219.05 g/mol.
Where can I buy 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone?
You can request a quote for 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-(4-nitrophenyl)-2(5H)-furanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.