Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-
TL;DR: Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- (CAS 95454-91-4) is a chemical compound with molecular formula C25H31NO4 and molecular weight 409.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-nitro-1-undecylbenzo[e][1]benzofuran-2-yl)ethanone
Also Known As: Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-, 1-(5-Nitro-1-undecylnaphtho(2,1-b)furan-2-yl)ethanone, 1-(5-nitro-1-undecylbenzo[e][1]benzofuran-2-yl)ethanone, 1-(5-Nitro-1-undecylnaphtho[2,1-b]furan-2-yl)ethan-1-one
| Molecular Formula | C25H31NO4 |
|---|---|
| Molecular Weight | 409.23 g/mol |
| LogP | 9.1 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 409.2253 |
| Heavy Atoms | 30 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 95454-91-4 |
|---|---|
| SMILES | CCCCCCCCCCCC1=C(OC2=C1C3=CC=CC=C3C(=C2)[N+](=O)[O-])C(=O)C |
| InChIKey | VCFMEOPGRHVLBV-UHFFFAOYSA-N |
Product Overview
Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- (CAS 95454-91-4), with molecular formula C25H31NO4 and molecular weight 409.23 g/mol. IUPAC: 1-(5-nitro-1-undecylbenzo[e][1]benzofuran-2-yl)ethanone.
Chemical Property Profile of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-
Property Insights of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-
The XLogP value of 9.1 indicates that Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-. Following Lipinski's Rule of Five, Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-?
The CAS number of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- is 95454-91-4.
What is the molecular formula of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-?
The molecular formula of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- is C25H31NO4.
What is the molecular weight of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-?
The molecular weight of Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- is 409.23 g/mol.
Where can I buy Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-?
You can request a quote for Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(5-nitro-1-undecylnaphtho(2,1-b)furan-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.