1-Nitroso-2-pyrrolidinone
TL;DR: 1-Nitroso-2-pyrrolidinone (CAS 54634-49-0) is a chemical compound with molecular formula C4H6N2O2 and molecular weight 114.04293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-nitrosopyrrolidin-2-one
Also Known As: 1-nitrosopyrrolidin-2-one, 2-Pyrrolidinone, 1-nitroso-, 1-Nitroso-2-pyrrolidinone, N-Nitroso-2-pyrrolidone, 2-Pyrrolidinone,1-nitroso-
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6N2O2 |
| Molecular Weight | 114.04293 g/mol |
| XLogP | -1.4 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.04293 Da |
| Heavy Atoms | 8 |
| Complexity | 123.0 |
| SMILES | C1CC(=O)N(C1)N=O |
| InChIKey | KLZYCEYOOVIITI-UHFFFAOYSA-N |
Chemical Property Profile of 1-Nitroso-2-pyrrolidinone
Property Insights of 1-Nitroso-2-pyrrolidinone
The XLogP value of -1.4 indicates that 1-Nitroso-2-pyrrolidinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.7 Ų, 1-Nitroso-2-pyrrolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitroso-2-pyrrolidinone has 0 hydrogen bond donor(s) and 3 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-Nitroso-2-pyrrolidinone?
The CAS number of 1-Nitroso-2-pyrrolidinone is 54634-49-0.
What is the molecular formula of 1-Nitroso-2-pyrrolidinone?
The molecular formula of 1-Nitroso-2-pyrrolidinone is C4H6N2O2.
What is the molecular weight of 1-Nitroso-2-pyrrolidinone?
The molecular weight of 1-Nitroso-2-pyrrolidinone is 114.04293 g/mol.
Where can I buy 1-Nitroso-2-pyrrolidinone?
You can request a quote for 1-Nitroso-2-pyrrolidinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Nitroso-2-pyrrolidinone?
Yes, CoreyChem provides custom synthesis services for 1-Nitroso-2-pyrrolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.