3-Phenylpropyl pyrrolidin-1-ylacetate
TL;DR: 3-Phenylpropyl pyrrolidin-1-ylacetate (CAS 351335-94-9) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylpropyl 2-pyrrolidin-1-ylacetate
Also Known As: ChemDiv2_000522, 3-phenylpropyl pyrrolidin-1-ylacetate, 3-phenylpropyl 2-pyrrolidin-1-ylacetate, 3-PHENYLPROPYL 2-(PYRROLIDIN-1-YL)ACETATE, Pyrrolidin-1-yl-acetic acid 3-phenyl-propyl ester
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 2.2582 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 358.01617 |
Chemical Identifiers
| CAS Number | 351335-94-9 |
|---|---|
| SMILES | C1CCN(C1)CC(=O)OCCCC2=CC=CC=C2 |
Product Overview
3-Phenylpropyl pyrrolidin-1-ylacetate (CAS 351335-94-9), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: 3-phenylpropyl 2-pyrrolidin-1-ylacetate.
Chemical Property Profile of 3-Phenylpropyl pyrrolidin-1-ylacetate
Property Insights of 3-Phenylpropyl pyrrolidin-1-ylacetate
The XLogP value of 2.2582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenylpropyl pyrrolidin-1-ylacetate. With a topological polar surface area (TPSA) of 29.54 Ų, 3-Phenylpropyl pyrrolidin-1-ylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylpropyl pyrrolidin-1-ylacetate has 0 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 3-Phenylpropyl pyrrolidin-1-ylacetate?
The CAS number of 3-Phenylpropyl pyrrolidin-1-ylacetate is 351335-94-9.
What is the molecular formula of 3-Phenylpropyl pyrrolidin-1-ylacetate?
The molecular formula of 3-Phenylpropyl pyrrolidin-1-ylacetate is C15H21NO2.
What is the molecular weight of 3-Phenylpropyl pyrrolidin-1-ylacetate?
The molecular weight of 3-Phenylpropyl pyrrolidin-1-ylacetate is 247.16 g/mol.
Where can I buy 3-Phenylpropyl pyrrolidin-1-ylacetate?
You can request a quote for 3-Phenylpropyl pyrrolidin-1-ylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylpropyl pyrrolidin-1-ylacetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylpropyl pyrrolidin-1-ylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.