Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride
TL;DR: Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride (CAS 16793-49-0) is a chemical compound with molecular formula C14H23Cl2NO and molecular weight 291.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanamine;hydrochloride
Also Known As: p-Cymene, 3-(2-(2-chloroethylamino)ethoxy)-, hydrochloride, Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride, beta-(N-(2-Chloroethyl)amino)-2-isopropyl-5-methylphenetole hydrochloride, Diethylamine, 2-chloro-2'-(thymyloxy)-, hydrochloride, N-(2-chloroethyl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanamine hydrochloride
| Molecular Formula | C14H23Cl2NO |
|---|---|
| Molecular Weight | 291.12 g/mol |
| LogP | 3.74742 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.11566 |
| Heavy Atoms | 18 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 16793-49-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCCNCCCl.Cl |
| InChIKey | WLTGYXAIGKLBHT-UHFFFAOYSA-N |
Product Overview
Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride (CAS 16793-49-0), with molecular formula C14H23Cl2NO and molecular weight 291.12 g/mol. IUPAC: N-(2-chloroethyl)-2-(5-methyl-2-propan-2-ylphenoxy)ethanamine;hydrochloride.
Chemical Property Profile of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride
Property Insights of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride
The XLogP value of 3.74742 indicates that Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride has 2 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 Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride?
The CAS number of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride is 16793-49-0.
What is the molecular formula of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride?
The molecular formula of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride is C14H23Cl2NO.
What is the molecular weight of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride?
The molecular weight of Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride is 291.12 g/mol.
Where can I buy Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride?
You can request a quote for Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Phenetole, beta-(N-(2-chloroethyl)amino)-2-isopropyl-5-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.