Phenyl-pyrrolidin-1-yl-acetic acid
TL;DR: Phenyl-pyrrolidin-1-yl-acetic acid (CAS 100390-48-5) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-2-pyrrolidin-1-ylacetic acid
Also Known As: Phenyl-pyrrolidin-1-yl-acetic acid, 2-phenyl-2-(pyrrolidin-1-yl)acetic acid, 2-phenyl-2-pyrrolidin-1-ylacetic acid, Phenylpyrrolidin-1-ylacetic Acid, 1-Pyrrolidineacetic acid, Alpha-phenyl-
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 100390-48-5 |
|---|---|
| SMILES | C1CCN(C1)C(C2=CC=CC=C2)C(=O)O |
| InChIKey | HYOZIYFGQLGJFY-UHFFFAOYSA-N |
Product Overview
Phenyl-pyrrolidin-1-yl-acetic acid (CAS 100390-48-5), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 2-phenyl-2-pyrrolidin-1-ylacetic acid.
Chemical Property Profile of Phenyl-pyrrolidin-1-yl-acetic acid
Property Insights of Phenyl-pyrrolidin-1-yl-acetic acid
The XLogP value of -0.2 indicates that Phenyl-pyrrolidin-1-yl-acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, Phenyl-pyrrolidin-1-yl-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl-pyrrolidin-1-yl-acetic acid has 1 hydrogen bond donor(s) and 3 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 Phenyl-pyrrolidin-1-yl-acetic acid?
The CAS number of Phenyl-pyrrolidin-1-yl-acetic acid is 100390-48-5.
What is the molecular formula of Phenyl-pyrrolidin-1-yl-acetic acid?
The molecular formula of Phenyl-pyrrolidin-1-yl-acetic acid is C12H15NO2.
What is the molecular weight of Phenyl-pyrrolidin-1-yl-acetic acid?
The molecular weight of Phenyl-pyrrolidin-1-yl-acetic acid is 205.11 g/mol.
Where can I buy Phenyl-pyrrolidin-1-yl-acetic acid?
You can request a quote for Phenyl-pyrrolidin-1-yl-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl-pyrrolidin-1-yl-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Phenyl-pyrrolidin-1-yl-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.