2,4-Dimethyl-5-nitrofuran-3-carboxylic acid
TL;DR: 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid (CAS 15139-38-5) is a chemical compound with molecular formula C7H7NO5 and molecular weight 185.03242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dimethyl-5-nitrofuran-3-carboxylic acid
Also Known As: 2,4-dimethyl-5-nitrofuran-3-carboxylic acid
Technical Specifications
| Molecular Formula | C7H7NO5 |
| Molecular Weight | 185.03242 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.03242 Da |
| Heavy Atoms | 13 |
| Complexity | 236.0 |
| SMILES | CC1=C(OC(=C1C(=O)O)C)[N+](=O)[O-] |
| InChIKey | JJZJVXDPNYLFLZ-UHFFFAOYSA-N |
Chemical Property Profile of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid
Property Insights of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid. Following Lipinski's Rule of Five, 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid?
The CAS number of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid is 15139-38-5.
What is the molecular formula of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid?
The molecular formula of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid is C7H7NO5.
What is the molecular weight of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid?
The molecular weight of 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid is 185.03242 g/mol.
Where can I buy 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid?
You can request a quote for 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2,4-Dimethyl-5-nitrofuran-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.