1-Nitrobiuret
TL;DR: 1-Nitrobiuret (CAS 16326-62-8) is a chemical compound with molecular formula C2H4N4O4 and molecular weight 148.02325 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-carbamoyl-3-nitrourea
Also Known As: NITROBIURET, 1-Nitrobiuret, 1-carbamoyl-3-nitrourea, Not Available, Imidodicarbonicdiamide, N-nitro-
Technical Specifications
| Molecular Formula | C2H4N4O4 |
| Molecular Weight | 148.02325 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.02325 Da |
| Heavy Atoms | 10 |
| Complexity | 171.0 |
| SMILES | C(=O)(N)NC(=O)N[N+](=O)[O-] |
| InChIKey | PDMSYILLGCPHSS-UHFFFAOYSA-N |
Chemical Property Profile of 1-Nitrobiuret
Property Insights of 1-Nitrobiuret
The XLogP value of -0.2 indicates that 1-Nitrobiuret is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitrobiuret. Following Lipinski's Rule of Five, 1-Nitrobiuret has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Nitrobiuret?
The CAS number of 1-Nitrobiuret is 16326-62-8.
What is the molecular formula of 1-Nitrobiuret?
The molecular formula of 1-Nitrobiuret is C2H4N4O4.
What is the molecular weight of 1-Nitrobiuret?
The molecular weight of 1-Nitrobiuret is 148.02325 g/mol.
Where can I buy 1-Nitrobiuret?
You can request a quote for 1-Nitrobiuret directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Nitrobiuret?
Yes, CoreyChem provides custom synthesis services for 1-Nitrobiuret and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.