2,5-Bis(hydroxymethyl)pyrrolidin-3-one
TL;DR: 2,5-Bis(hydroxymethyl)pyrrolidin-3-one (CAS 114417-01-5) is a chemical compound with molecular formula C6H11NO3 and molecular weight 145.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(hydroxymethyl)pyrrolidin-3-one
Also Known As: 2,5-bis(hydroxymethyl)pyrrolidin-3-one, 3-Pyrrolidinone,2,5-bis(hydroxymethyl)-, 3-Pyrrolidinone, 2,5-bis(hydroxymethyl)-, 1,2-Cyclobutanedicarboxylicacid,1-amino, 3-Pyrrolidinone, 2,5-bis(hydroxymethyl)- (9CI)
| Molecular Formula | C6H11NO3 |
|---|---|
| Molecular Weight | 145.07 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 145.0739 |
| Heavy Atoms | 10 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 114417-01-5 |
|---|---|
| SMILES | C1C(NC(C1=O)CO)CO |
| InChIKey | NDFDVAQGBIIVEY-UHFFFAOYSA-N |
Product Overview
2,5-Bis(hydroxymethyl)pyrrolidin-3-one (CAS 114417-01-5), with molecular formula C6H11NO3 and molecular weight 145.07 g/mol. IUPAC: 2,5-bis(hydroxymethyl)pyrrolidin-3-one.
Chemical Property Profile of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one
Property Insights of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one
The XLogP value of -1.4 indicates that 2,5-Bis(hydroxymethyl)pyrrolidin-3-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Bis(hydroxymethyl)pyrrolidin-3-one. Following Lipinski's Rule of Five, 2,5-Bis(hydroxymethyl)pyrrolidin-3-one has 3 hydrogen bond donor(s) and 4 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-Bis(hydroxymethyl)pyrrolidin-3-one?
The CAS number of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one is 114417-01-5.
What is the molecular formula of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one?
The molecular formula of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one is C6H11NO3.
What is the molecular weight of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one?
The molecular weight of 2,5-Bis(hydroxymethyl)pyrrolidin-3-one is 145.07 g/mol.
Where can I buy 2,5-Bis(hydroxymethyl)pyrrolidin-3-one?
You can request a quote for 2,5-Bis(hydroxymethyl)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 2,5-Bis(hydroxymethyl)pyrrolidin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Bis(hydroxymethyl)pyrrolidin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.