![2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one structure](/static/products/170/170807-19-9.png)
2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one
TL;DR: 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one (CAS 170807-19-9) is a chemical compound with molecular formula C17H11NO6 and molecular weight 325.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitrochromen-4-one
Also Known As: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitrochromen-4-one, 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6-nitro-4H-chromen-4-one, 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one, 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitro-4H-chromen-4-one, 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6-nitro-4H-chromen-4-one [M+H]+
| Molecular Formula | C17H11NO6 |
|---|---|
| Molecular Weight | 325.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 90.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 325.05862 |
| Heavy Atoms | 24 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 170807-19-9 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=CC(=O)C4=C(O3)C=CC(=C4)[N+](=O)[O-] |
| InChIKey | YMCYJIJWKFYPMN-UHFFFAOYSA-N |
Product Overview
2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one (CAS 170807-19-9), with molecular formula C17H11NO6 and molecular weight 325.06 g/mol. IUPAC: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitrochromen-4-one.
Chemical Property Profile of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one
Property Insights of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one. The TPSA of 90.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one. Following Lipinski's Rule of Five, 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one 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-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one?
The CAS number of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one is 170807-19-9.
What is the molecular formula of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one?
The molecular formula of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one is C17H11NO6.
What is the molecular weight of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one?
The molecular weight of 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one is 325.06 g/mol.
Where can I buy 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one?
You can request a quote for 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2H,3H-benzo[e]1,4-dioxin-6-yl)-6-nitrochromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.