2,5-dihydro-1H-pyrrol-2-one
TL;DR: 2,5-dihydro-1H-pyrrol-2-one (CAS 89686-41-9) is a chemical compound with molecular formula C4H5NO and molecular weight 83.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dihydropyrrol-5-one
Also Known As: 3-pyrroline-2-one, 3-pyrrolin-2-one, 1,5-dihydro-2H-pyrrol-2-one, 1,5-DIHYDRO-PYRROL-2-ONE, 2H-Pyrrol-5-ol
| Molecular Formula | C4H5NO |
|---|---|
| Molecular Weight | 83.04 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 83.03712 |
| Heavy Atoms | 6 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 89686-41-9 |
|---|---|
| SMILES | C1C=CC(=O)N1 |
| InChIKey | CDCHBOQVXIGZHA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-dihydro-1H-pyrrol-2-one (CAS 89686-41-9), with molecular formula C4H5NO and molecular weight 83.04 g/mol. IUPAC: 1,2-dihydropyrrol-5-one.
Chemical Property Profile of 2,5-dihydro-1H-pyrrol-2-one
Property Insights of 2,5-dihydro-1H-pyrrol-2-one
The XLogP value of -0.4 indicates that 2,5-dihydro-1H-pyrrol-2-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, 2,5-dihydro-1H-pyrrol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-dihydro-1H-pyrrol-2-one has 1 hydrogen bond donor(s) and 1 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 2,5-dihydro-1H-pyrrol-2-one?
The CAS number of 2,5-dihydro-1H-pyrrol-2-one is 89686-41-9.
What is the molecular formula of 2,5-dihydro-1H-pyrrol-2-one?
The molecular formula of 2,5-dihydro-1H-pyrrol-2-one is C4H5NO.
What is the molecular weight of 2,5-dihydro-1H-pyrrol-2-one?
The molecular weight of 2,5-dihydro-1H-pyrrol-2-one is 83.04 g/mol.
Where can I buy 2,5-dihydro-1H-pyrrol-2-one?
You can request a quote for 2,5-dihydro-1H-pyrrol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-dihydro-1H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5-dihydro-1H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.