Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate
TL;DR: Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate (CAS 73986-59-1) is a chemical compound with molecular formula C17H25NO2 and molecular weight 275.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[1-(1-methylpyrrolidin-3-yl)butyl]phenyl] acetate
Also Known As: 3-(1-(1-Methyl-3-pyrrolidinyl)butyl)phenol acetate, Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate, 3-[1-(1-Methylpyrrolidin-3-yl)butyl]phenyl acetate, [3-[1-(1-methylpyrrolidin-3-yl)butyl]phenyl] acetate, Acetic acid 3-[1-(1-methyl-3-pyrrolidinyl)butyl]phenyl ester
| Molecular Formula | C17H25NO2 |
|---|---|
| Molecular Weight | 275.19 g/mol |
| LogP | 3.4473 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.18854 |
| Heavy Atoms | 20 |
| Complexity | 458.05817 |
Chemical Identifiers
| CAS Number | 73986-59-1 |
|---|---|
| SMILES | CCCC(C1CCN(C1)C)C2=CC(=CC=C2)OC(=O)C |
Product Overview
Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate (CAS 73986-59-1), with molecular formula C17H25NO2 and molecular weight 275.19 g/mol. IUPAC: [3-[1-(1-methylpyrrolidin-3-yl)butyl]phenyl] acetate.
Chemical Property Profile of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate
Property Insights of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate
The XLogP value of 3.4473 indicates that Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, 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 Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate?
The CAS number of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate is 73986-59-1.
What is the molecular formula of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate?
The molecular formula of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate is C17H25NO2.
What is the molecular weight of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate?
The molecular weight of Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate is 275.19 g/mol.
Where can I buy Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate?
You can request a quote for Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 3-(1-(1-methyl-3-pyrrolidinyl)butyl)-, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.