2-Pyrrolidinemethanesulfonic acid
TL;DR: 2-Pyrrolidinemethanesulfonic acid (CAS 139644-71-6) is a chemical compound with molecular formula C5H11NO3S and molecular weight 165.04596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyrrolidin-2-ylmethanesulfonic acid
Also Known As: 2-Pyrrolidinemethanesulfonic acid, (S)-Pyrrolidin-2-ylmethanesulfonic acid, Pyrrolidin-2-ylmethanesulfonic Acid, 2-Pyrrolidinylmethanesulfonic acid, (S)-2-Pyrrolidinemethanesulfonic acid
Technical Specifications
| Molecular Formula | C5H11NO3S |
| Molecular Weight | 165.04596 g/mol |
| XLogP | -3.0 |
| Topological Polar Surface Area (TPSA) | 74.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.04596 Da |
| Heavy Atoms | 10 |
| Complexity | 193.0 |
| SMILES | C1CC(NC1)CS(=O)(=O)O |
| InChIKey | JYFHRLOWRFUNPU-UHFFFAOYSA-N |
Chemical Property Profile of 2-Pyrrolidinemethanesulfonic acid
Property Insights of 2-Pyrrolidinemethanesulfonic acid
The XLogP value of -3.0 indicates that 2-Pyrrolidinemethanesulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyrrolidinemethanesulfonic acid. Following Lipinski's Rule of Five, 2-Pyrrolidinemethanesulfonic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Pyrrolidinemethanesulfonic acid?
The CAS number of 2-Pyrrolidinemethanesulfonic acid is 139644-71-6.
What is the molecular formula of 2-Pyrrolidinemethanesulfonic acid?
The molecular formula of 2-Pyrrolidinemethanesulfonic acid is C5H11NO3S.
What is the molecular weight of 2-Pyrrolidinemethanesulfonic acid?
The molecular weight of 2-Pyrrolidinemethanesulfonic acid is 165.04596 g/mol.
Where can I buy 2-Pyrrolidinemethanesulfonic acid?
You can request a quote for 2-Pyrrolidinemethanesulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Pyrrolidinemethanesulfonic acid?
Yes, CoreyChem provides custom synthesis services for 2-Pyrrolidinemethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.