Nitrofurantoin Monohydrate
TL;DR: Nitrofurantoin Monohydrate (CAS 152984-59-3) is a chemical compound with molecular formula C8H8N4O6 and molecular weight 256.04437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-(5-nitrofuran-2-yl)methylideneamino]imidazolidine-2,4-dione;hydrate
Also Known As: Furadantin monohydrate, NITROFURANTOIN MONOHYDRATE, Nitrofurantoin, Monohydrate, Nitrofurantoin1-Hydrate, Nitrofurantoin (monohydrate)
Technical Specifications
| Molecular Formula | C8H8N4O6 |
| Molecular Weight | 256.04437 g/mol |
| XLogP | -0.7512 |
| Topological Polar Surface Area (TPSA) | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.04437 Da |
| Heavy Atoms | 18 |
| Complexity | 390.0 |
| SMILES | C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)[N+](=O)[O-].O |
| InChIKey | NHBPVLAHAVEISO-JSGFVSQVSA-N |
Chemical Property Profile of Nitrofurantoin Monohydrate
Property Insights of Nitrofurantoin Monohydrate
The XLogP value of -0.7512 indicates that Nitrofurantoin Monohydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitrofurantoin Monohydrate. Following Lipinski's Rule of Five, Nitrofurantoin Monohydrate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nitrofurantoin Monohydrate?
The CAS number of Nitrofurantoin Monohydrate is 152984-59-3.
What is the molecular formula of Nitrofurantoin Monohydrate?
The molecular formula of Nitrofurantoin Monohydrate is C8H8N4O6.
What is the molecular weight of Nitrofurantoin Monohydrate?
The molecular weight of Nitrofurantoin Monohydrate is 256.04437 g/mol.
Where can I buy Nitrofurantoin Monohydrate?
You can request a quote for Nitrofurantoin Monohydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nitrofurantoin Monohydrate?
Yes, CoreyChem provides custom synthesis services for Nitrofurantoin Monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.