4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-
TL;DR: 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- (CAS 131924-51-1) is a chemical compound with molecular formula C12H8N4O4 and molecular weight 272.05457 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methyltriazol-4-yl)-6-nitrochromen-4-one
Also Known As: 2-(2-methyltriazol-4-yl)-6-nitrochromen-4-one, 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-, 2-(2-Methyl-1H-1,2,3-triazol-4-yl)-6-nitro-4H-1-benzopyran-4-one, 2-(2-Methyl-2H-1,2,3-triazol-4-yl)-6-nitro-4H-chromen-4-one, 2-(2-Methyl-2H-1,2,3-triazol-4-yl)-6-nitro-4H-1-benzopyran-4-one
Technical Specifications
| Molecular Formula | C12H8N4O4 |
| Molecular Weight | 272.05457 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.05457 Da |
| Heavy Atoms | 20 |
| Complexity | 461.0 |
| SMILES | CN1N=CC(=N1)C2=CC(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-] |
| InChIKey | DDYCMSYNMLZSRP-UHFFFAOYSA-N |
Chemical Property Profile of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-
Property Insights of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- 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
What is the CAS number of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-?
The CAS number of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- is 131924-51-1.
What is the molecular formula of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-?
The molecular formula of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- is C12H8N4O4.
What is the molecular weight of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-?
The molecular weight of 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- is 272.05457 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-?
You can request a quote for 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro-?
Yes, CoreyChem provides custom synthesis services for 4H-1-Benzopyran-4-one, 2-(2-methyl-1H-1,2,3-triazol-4-yl)-6-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.