![Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate structure](/static/products/3306/330683-82-4.webp)
Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate
TL;DR: Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate (CAS 330683-82-4) is a chemical compound with molecular formula C16H13NO6 and molecular weight 315.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate
Also Known As: methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate, METHYL 2-ACETYL-3-(5-(3-NITROPHENYL)-2-FURYL)ACRYLATE
| Molecular Formula | C16H13NO6 |
|---|---|
| Molecular Weight | 315.07 g/mol |
| LogP | 3.0002 |
| Topological Polar Surface Area | 99.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.07428 |
| Heavy Atoms | 23 |
| Complexity | 802.40674 |
Chemical Identifiers
| CAS Number | 330683-82-4 |
|---|---|
| SMILES | CC(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC |
Product Overview
Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate (CAS 330683-82-4), with molecular formula C16H13NO6 and molecular weight 315.07 g/mol. IUPAC: methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate.
Chemical Property Profile of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate
Property Insights of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate
The XLogP value of 3.0002 indicates that Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.65 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate. Following Lipinski's Rule of Five, Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate 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 Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate?
The CAS number of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate is 330683-82-4.
What is the molecular formula of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate?
The molecular formula of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate is C16H13NO6.
What is the molecular weight of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate?
The molecular weight of Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate is 315.07 g/mol.
Where can I buy Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate?
You can request a quote for Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-3-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.