Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester
TL;DR: Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester (CAS 17184-85-9) 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-(1-methyl-3-propylazetidin-3-yl)phenyl] acetate
Also Known As: 3-(1-Methyl-3-propyl-3-azetidinyl)phenol acetate, Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester, 3-(1-methyl-3-propylazetidin-3-yl)phenyl acetate, [3-(1-methyl-3-propylazetidin-3-yl)phenyl] acetate, Acetic acid 3-(1-methyl-3-propyl-3-azetidinyl)phenyl ester
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 17184-85-9 |
|---|---|
| SMILES | CCCC1(CN(C1)C)C2=CC(=CC=C2)OC(=O)C |
| InChIKey | RNHRBVLFTLTWHO-UHFFFAOYSA-N |
Product Overview
Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester (CAS 17184-85-9), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: [3-(1-methyl-3-propylazetidin-3-yl)phenyl] acetate.
Chemical Property Profile of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester
Property Insights of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester
The XLogP value of 3.0 indicates that Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester 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-methyl-3-propyl-3-azetidinyl)-acetate ester?
The CAS number of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester is 17184-85-9.
What is the molecular formula of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester?
The molecular formula of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester is C15H21NO2.
What is the molecular weight of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester?
The molecular weight of Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester is 247.16 g/mol.
Where can I buy Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester?
You can request a quote for Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester 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-methyl-3-propyl-3-azetidinyl)-acetate ester?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 3-(1-methyl-3-propyl-3-azetidinyl)-acetate ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.