(3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol
TL;DR: (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol (CAS 163439-82-5) is a chemical compound with molecular formula C11H16NO2+ and molecular weight 194.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol
Also Known As: (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol, (3R,4R)-(-)-1-Benzyl-3,4-pyrrolidinediol
| Molecular Formula | C11H16NO2+ |
|---|---|
| Molecular Weight | 194.12 g/mol |
| LogP | -1.1931 |
| Topological Polar Surface Area | 44.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.1181 |
| Heavy Atoms | 14 |
| Complexity | 278.59882 |
Chemical Identifiers
| CAS Number | 163439-82-5 |
|---|---|
| SMILES | C1[C@H]([C@@H](C[NH+]1CC2=CC=CC=C2)O)O |
Product Overview
(3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol (CAS 163439-82-5), with molecular formula C11H16NO2+ and molecular weight 194.12 g/mol. IUPAC: (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol.
Chemical Property Profile of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol
Property Insights of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol
The XLogP value of -1.1931 indicates that (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.9 Ų, (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol has 3 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 (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol?
The CAS number of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol is 163439-82-5.
What is the molecular formula of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol?
The molecular formula of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol is C11H16NO2+.
What is the molecular weight of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol?
The molecular weight of (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol is 194.12 g/mol.
Where can I buy (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol?
You can request a quote for (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for (3R,4R)-1-benzylpyrrolidin-1-ium-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.