![2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- structure](/static/products/301/301165-06-0.png)
2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-
TL;DR: 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- (CAS 301165-06-0) is a chemical compound with molecular formula C16H8N2O8 and molecular weight 356.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxochromen-7-yl) 3,5-dinitrobenzoate
Also Known As: (2-oxochromen-7-yl) 3,5-dinitrobenzoate, 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-, 7-(3,5-DINITROBENZOYLOXY)COUMARIN, 2-Oxo-2H-1-benzopyran-7-yl 3,5-dinitrobenzoate
| Molecular Formula | C16H8N2O8 |
|---|---|
| Molecular Weight | 356.03 g/mol |
| LogP | 2.8286 |
| Topological Polar Surface Area | 142.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.02808 |
| Heavy Atoms | 26 |
| Complexity | 1086.428 |
Chemical Identifiers
| CAS Number | 301165-06-0 |
|---|---|
| SMILES | C1=CC(=CC2=C1C=CC(=O)O2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- (CAS 301165-06-0), with molecular formula C16H8N2O8 and molecular weight 356.03 g/mol. IUPAC: (2-oxochromen-7-yl) 3,5-dinitrobenzoate.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-
Property Insights of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-
The XLogP value of 2.8286 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-. The TPSA of 142.79 Ų indicates high polarity, suggesting 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- has 0 hydrogen bond donor(s) and 8 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 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-?
The CAS number of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- is 301165-06-0.
What is the molecular formula of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-?
The molecular formula of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- is C16H8N2O8.
What is the molecular weight of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-?
The molecular weight of 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- is 356.03 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-?
You can request a quote for 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 7-[(3,5-dinitrobenzoyl)oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.