2-(1-Benzyl-3-pyrrolidinyl)acetic acid
TL;DR: 2-(1-Benzyl-3-pyrrolidinyl)acetic acid (CAS 28719-93-9) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzylpyrrolidin-3-yl)acetic acid
Also Known As: 2-(1-BENZYL-3-PYRROLIDINYL)ACETIC ACID, 2-(1-benzylpyrrolidin-3-yl)acetic Acid, (1-benzylpyrrolidin-3-yl)acetic acid, 7697AE, 2-(1-benzylpyrrolidin-3-yl)aceticAcid
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 1.9832 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 350.21005 |
Chemical Identifiers
| CAS Number | 28719-93-9 |
|---|---|
| SMILES | C1CN(CC1CC(=O)O)CC2=CC=CC=C2 |
Product Overview
2-(1-Benzyl-3-pyrrolidinyl)acetic acid (CAS 28719-93-9), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 2-(1-benzylpyrrolidin-3-yl)acetic acid.
Chemical Property Profile of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid
Property Insights of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid
The XLogP value of 1.9832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Benzyl-3-pyrrolidinyl)acetic acid. With a topological polar surface area (TPSA) of 40.54 Ų, 2-(1-Benzyl-3-pyrrolidinyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Benzyl-3-pyrrolidinyl)acetic acid 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 2-(1-Benzyl-3-pyrrolidinyl)acetic acid?
The CAS number of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid is 28719-93-9.
What is the molecular formula of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid?
The molecular formula of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid is C13H17NO2.
What is the molecular weight of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid?
The molecular weight of 2-(1-Benzyl-3-pyrrolidinyl)acetic acid is 219.13 g/mol.
Where can I buy 2-(1-Benzyl-3-pyrrolidinyl)acetic acid?
You can request a quote for 2-(1-Benzyl-3-pyrrolidinyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Benzyl-3-pyrrolidinyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Benzyl-3-pyrrolidinyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.