1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one
TL;DR: 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one (CAS 102202-80-2) is a chemical compound with molecular formula C11H9N3O6 and molecular weight 279.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dinitrobenzoyl)pyrrolidin-2-one
Also Known As: 1-(3,5-dinitrobenzoyl)pyrrolidin-2-one
| Molecular Formula | C11H9N3O6 |
|---|---|
| Molecular Weight | 279.05 g/mol |
| LogP | 1.2656 |
| Topological Polar Surface Area | 123.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.04913 |
| Heavy Atoms | 20 |
| Complexity | 594.33453 |
Chemical Identifiers
| CAS Number | 102202-80-2 |
|---|---|
| SMILES | C1CC(=O)N(C1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one (CAS 102202-80-2), with molecular formula C11H9N3O6 and molecular weight 279.05 g/mol. IUPAC: 1-(3,5-dinitrobenzoyl)pyrrolidin-2-one.
Chemical Property Profile of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one
Property Insights of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one
The XLogP value of 1.2656 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one. The TPSA of 123.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one. Following Lipinski's Rule of Five, 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one has 0 hydrogen bond donor(s) and 6 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-(3,5-Dinitrobenzoyl)pyrrolidin-2-one?
The CAS number of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one is 102202-80-2.
What is the molecular formula of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one?
The molecular formula of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one is C11H9N3O6.
What is the molecular weight of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one?
The molecular weight of 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one is 279.05 g/mol.
Where can I buy 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one?
You can request a quote for 1-(3,5-Dinitrobenzoyl)pyrrolidin-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-(3,5-Dinitrobenzoyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Dinitrobenzoyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.