3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate
TL;DR: 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate (CAS 1623-32-1) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1-methyl-3-propylpyrrolidin-3-yl)phenyl] acetate
Also Known As: triallylphosphate, starbld0029115, Phenol, m-(1-methyl-3-propyl-3-pyrrolidinyl)-, acetate, 3-m-Acetoxyphenyl-1-methyl-3-propylpyrrolidine, 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 1623-32-1 |
|---|---|
| SMILES | CCCC1(CCN(C1)C)C2=CC(=CC=C2)OC(=O)C |
| InChIKey | JSVPVVXSCRJFAT-UHFFFAOYSA-N |
Product Overview
3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate (CAS 1623-32-1), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: [3-(1-methyl-3-propylpyrrolidin-3-yl)phenyl] acetate.
Chemical Property Profile of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate
Property Insights of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate
The XLogP value of 3.3 indicates that 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate 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-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate?
The CAS number of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate is 1623-32-1.
What is the molecular formula of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate?
The molecular formula of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate is C16H23NO2.
What is the molecular weight of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate?
The molecular weight of 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate is 261.17 g/mol.
Where can I buy 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate?
You can request a quote for 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Methyl-3-propylpyrrolidin-3-yl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.