methyl (2S)-pyrrolidin-1-ium-2-carboxylate
TL;DR: methyl (2S)-pyrrolidin-1-ium-2-carboxylate (CAS 2133-40-6) is a chemical compound with molecular formula C6H12NO2+ and molecular weight 130.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-pyrrolidin-1-ium-2-carboxylate
Also Known As: H-Pro-OMe.HCl, 1-Azoniaproline methyl ester, L-Proline methyl ester hydrochloride, (2S)-2-(methoxycarbonyl)pyrrolidin-1-ylium, methyl (2S)-pyrrolidin-1-ium-2-carboxylate
| Molecular Formula | C6H12NO2+ |
|---|---|
| Molecular Weight | 130.09 g/mol |
| LogP | -1.1148 |
| Topological Polar Surface Area | 42.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 130.0868 |
| Heavy Atoms | 9 |
| Complexity | 107.62549 |
Chemical Identifiers
| CAS Number | 2133-40-6 |
|---|---|
| SMILES | COC(=O)[C@@H]1CCC[NH2+]1 |
Product Overview
methyl (2S)-pyrrolidin-1-ium-2-carboxylate (CAS 2133-40-6), with molecular formula C6H12NO2+ and molecular weight 130.09 g/mol. IUPAC: methyl (2S)-pyrrolidin-1-ium-2-carboxylate.
Chemical Property Profile of methyl (2S)-pyrrolidin-1-ium-2-carboxylate
Property Insights of methyl (2S)-pyrrolidin-1-ium-2-carboxylate
The XLogP value of -1.1148 indicates that methyl (2S)-pyrrolidin-1-ium-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.91 Ų, methyl (2S)-pyrrolidin-1-ium-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (2S)-pyrrolidin-1-ium-2-carboxylate 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 methyl (2S)-pyrrolidin-1-ium-2-carboxylate?
The CAS number of methyl (2S)-pyrrolidin-1-ium-2-carboxylate is 2133-40-6.
What is the molecular formula of methyl (2S)-pyrrolidin-1-ium-2-carboxylate?
The molecular formula of methyl (2S)-pyrrolidin-1-ium-2-carboxylate is C6H12NO2+.
What is the molecular weight of methyl (2S)-pyrrolidin-1-ium-2-carboxylate?
The molecular weight of methyl (2S)-pyrrolidin-1-ium-2-carboxylate is 130.09 g/mol.
Where can I buy methyl (2S)-pyrrolidin-1-ium-2-carboxylate?
You can request a quote for methyl (2S)-pyrrolidin-1-ium-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (2S)-pyrrolidin-1-ium-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2S)-pyrrolidin-1-ium-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.