6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-
TL;DR: 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- (CAS 62391-07-5) is a chemical compound with molecular formula C15H13NO7 and molecular weight 319.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
Also Known As: 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-, 8-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione, 8-[(2E)-3-(5-Nitro-2-furyl)prop-2-en-1-ylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione, 8-[(2E)-3-(5-Nitrofuran-2-yl)prop-2-en-1-ylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione, 8-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione
| Molecular Formula | C15H13NO7 |
|---|---|
| Molecular Weight | 319.07 g/mol |
| LogP | 2.4977 |
| Topological Polar Surface Area | 108.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.0692 |
| Heavy Atoms | 23 |
| Complexity | 699.9388 |
Chemical Identifiers
| CAS Number | 62391-07-5 |
|---|---|
| SMILES | C1CCC2(C1)OC(=O)C(=C/C=C/C3=CC=C(O3)[N+](=O)[O-])C(=O)O2 |
Product Overview
6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- (CAS 62391-07-5), with molecular formula C15H13NO7 and molecular weight 319.07 g/mol. IUPAC: 8-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]-6,10-dioxaspiro[4.5]decane-7,9-dione.
Chemical Property Profile of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-
Property Insights of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-
The XLogP value of 2.4977 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-. The TPSA of 108.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-. Following Lipinski's Rule of Five, 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- has 0 hydrogen bond donor(s) and 7 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 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-?
The CAS number of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- is 62391-07-5.
What is the molecular formula of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-?
The molecular formula of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- is C15H13NO7.
What is the molecular weight of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-?
The molecular weight of 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- is 319.07 g/mol.
Where can I buy 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-?
You can request a quote for 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]-?
Yes, KEHONG BIO provides custom synthesis services for 6,9-dione, 8-[3-(5-nitro-2-furanyl)-2-propenylidene]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.