1-Nitroimidazolidin-2-one
TL;DR: 1-Nitroimidazolidin-2-one (CAS 77084-61-8) is a chemical compound with molecular formula C3H5N3O3 and molecular weight 131.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitroimidazolidin-2-one
Also Known As: 1-nitroimidazolidin-2-one, 3-Nitroimidazolidine-2-one, 2-Imidazolidinone, 1-nitro-, 2-Imidazolidinone, 1-nitro- (9CI), J3.649.028D
| Molecular Formula | C3H5N3O3 |
|---|---|
| Molecular Weight | 131.03 g/mol |
| LogP | -0.7967 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.0331 |
| Heavy Atoms | 9 |
| Complexity | 156.38196 |
Chemical Identifiers
| CAS Number | 77084-61-8 |
|---|---|
| SMILES | C1CN(C(=O)N1)[N+](=O)[O-] |
Product Overview
1-Nitroimidazolidin-2-one (CAS 77084-61-8), with molecular formula C3H5N3O3 and molecular weight 131.03 g/mol. IUPAC: 1-nitroimidazolidin-2-one.
Chemical Property Profile of 1-Nitroimidazolidin-2-one
Property Insights of 1-Nitroimidazolidin-2-one
The XLogP value of -0.7967 indicates that 1-Nitroimidazolidin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitroimidazolidin-2-one. Following Lipinski's Rule of Five, 1-Nitroimidazolidin-2-one has 1 hydrogen bond donor(s) and 3 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 1-Nitroimidazolidin-2-one?
The CAS number of 1-Nitroimidazolidin-2-one is 77084-61-8.
What is the molecular formula of 1-Nitroimidazolidin-2-one?
The molecular formula of 1-Nitroimidazolidin-2-one is C3H5N3O3.
What is the molecular weight of 1-Nitroimidazolidin-2-one?
The molecular weight of 1-Nitroimidazolidin-2-one is 131.03 g/mol.
Where can I buy 1-Nitroimidazolidin-2-one?
You can request a quote for 1-Nitroimidazolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitroimidazolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitroimidazolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.