4,7-dimethyl-6-nitro-2H-chromen-2-one
TL;DR: 4,7-dimethyl-6-nitro-2H-chromen-2-one (CAS 6208-43-1) 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.
4,7-dimethyl-6-nitrochromen-2-one
Also Known As: 4,7-dimethyl-6-nitro-2H-chromen-2-one, 4,7-dimethyl-6-nitrochromen-2-one, 4,7-Dimethyl-6-nitro-chromen-2-one, BAS 03602934, BIM-0024467.P001
| Molecular Formula | C11H9NO4 |
|---|---|
| Molecular Weight | 219.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.05316 |
| Heavy Atoms | 16 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 6208-43-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1[N+](=O)[O-])C(=CC(=O)O2)C |
| InChIKey | LFBQEZTXFHKTPY-UHFFFAOYSA-N |
Product Overview
4,7-dimethyl-6-nitro-2H-chromen-2-one (CAS 6208-43-1), with molecular formula C11H9NO4 and molecular weight 219.05 g/mol. IUPAC: 4,7-dimethyl-6-nitrochromen-2-one.
Chemical Property Profile of 4,7-dimethyl-6-nitro-2H-chromen-2-one
Property Insights of 4,7-dimethyl-6-nitro-2H-chromen-2-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-dimethyl-6-nitro-2H-chromen-2-one. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,7-dimethyl-6-nitro-2H-chromen-2-one. Following Lipinski's Rule of Five, 4,7-dimethyl-6-nitro-2H-chromen-2-one 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 4,7-dimethyl-6-nitro-2H-chromen-2-one?
The CAS number of 4,7-dimethyl-6-nitro-2H-chromen-2-one is 6208-43-1.
What is the molecular formula of 4,7-dimethyl-6-nitro-2H-chromen-2-one?
The molecular formula of 4,7-dimethyl-6-nitro-2H-chromen-2-one is C11H9NO4.
What is the molecular weight of 4,7-dimethyl-6-nitro-2H-chromen-2-one?
The molecular weight of 4,7-dimethyl-6-nitro-2H-chromen-2-one is 219.05 g/mol.
Where can I buy 4,7-dimethyl-6-nitro-2H-chromen-2-one?
You can request a quote for 4,7-dimethyl-6-nitro-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-dimethyl-6-nitro-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4,7-dimethyl-6-nitro-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.