Pyrrolidin-3-one
TL;DR: Pyrrolidin-3-one (CAS 3760-52-9) is a chemical compound with molecular formula C4H7NO and molecular weight 85.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrrolidin-3-one
Also Known As: 3-Pyrrolidinone, Pyrrolidin-3-one, 3-Pyrrolidone, 3-Oxopyrrolidine, pyrrolidine-3-one
| Molecular Formula | C4H7NO |
|---|---|
| Molecular Weight | 85.05 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 85.052765 |
| Heavy Atoms | 6 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 3760-52-9 |
|---|---|
| SMILES | C1CNCC1=O |
| InChIKey | QGKLPGKXAVVPOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrrolidin-3-one (CAS 3760-52-9), with molecular formula C4H7NO and molecular weight 85.05 g/mol. IUPAC: pyrrolidin-3-one.
Chemical Property Profile of Pyrrolidin-3-one
Property Insights of Pyrrolidin-3-one
The XLogP value of -0.7 indicates that Pyrrolidin-3-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.1 Ų, Pyrrolidin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidin-3-one has 1 hydrogen bond donor(s) and 2 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 Pyrrolidin-3-one?
The CAS number of Pyrrolidin-3-one is 3760-52-9.
What is the molecular formula of Pyrrolidin-3-one?
The molecular formula of Pyrrolidin-3-one is C4H7NO.
What is the molecular weight of Pyrrolidin-3-one?
The molecular weight of Pyrrolidin-3-one is 85.05 g/mol.
Where can I buy Pyrrolidin-3-one?
You can request a quote for Pyrrolidin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidin-3-one?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.