Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride
TL;DR: Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride (CAS 20809-00-1) is a chemical compound with molecular formula C14H22ClNO2 and molecular weight 271.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-[2-(2-methylpropanoyl)phenoxy]ethyl]azanium chloride
Also Known As: Isobutyrophenone, 6'-(2-(dimethylamino)ethoxy)-, hydrochloride, 2-Isobutyryl-beta-(N,N-dimethyl)phenoxyethylamine, hydrochloride, ISOBUTYROPHENONE, 2'-(2-(DIMETHYLAMINO)ETHOXY)-, HYDROCHLORIDE, dimethyl-[2-[2-(2-methylpropanoyl)phenoxy]ethyl]azanium chloride, dimethyl-[2-[2-(2-methylpropanoyl)phenoxy]ethyl]azanium,chloride
| Molecular Formula | C14H22ClNO2 |
|---|---|
| Molecular Weight | 271.13 g/mol |
| LogP | -1.95 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 271.1339 |
| Heavy Atoms | 18 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 20809-00-1 |
|---|---|
| SMILES | CC(C)C(=O)C1=CC=CC=C1OCC[NH+](C)C.[Cl-] |
| InChIKey | CYGWEGXZLCSMCI-UHFFFAOYSA-N |
Product Overview
Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride (CAS 20809-00-1), with molecular formula C14H22ClNO2 and molecular weight 271.13 g/mol. IUPAC: dimethyl-[2-[2-(2-methylpropanoyl)phenoxy]ethyl]azanium chloride.
Chemical Property Profile of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride
Property Insights of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride
The XLogP value of -1.95 indicates that Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride has 1 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 Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride?
The CAS number of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride is 20809-00-1.
What is the molecular formula of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride?
The molecular formula of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride is C14H22ClNO2.
What is the molecular weight of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride?
The molecular weight of Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride is 271.13 g/mol.
Where can I buy Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride?
You can request a quote for Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isobutyrophenone, 2'-(2-(dimethylamino)ethoxy)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.