Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride
TL;DR: Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride (CAS 20809-29-4) is a chemical compound with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-butanoylphenoxy)ethyl-di(propan-2-yl)azanium chloride
Also Known As: 4'-(2-(Diisopropylamino)ethoxy)butyrophenone hydrochloride, 2-(4-butanoylphenoxy)ethyl-di(propan-2-yl)azanium chloride, 4-Butyryl-beta-(N,N-diisopropyl)phenoxyethylamine, hydrochloride, BUTYROPHENONE, 4'-(2-(DIISOPROPYLAMINO)ETHOXY)-, HYDROCHLORIDE, RefChem:331386
| Molecular Formula | C18H30ClNO2 |
|---|---|
| Molecular Weight | 327.20 g/mol |
| LogP | -0.25 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 327.1965 |
| Heavy Atoms | 22 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 20809-29-4 |
|---|---|
| SMILES | CCCC(=O)C1=CC=C(C=C1)OCC[NH+](C(C)C)C(C)C.[Cl-] |
| InChIKey | BJWPDHNGNFMSII-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride (CAS 20809-29-4), with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol. IUPAC: 2-(4-butanoylphenoxy)ethyl-di(propan-2-yl)azanium chloride.
Chemical Property Profile of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride
Property Insights of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride
The XLogP value of -0.25 indicates that Butyrophenone, 4'-(2-(diisopropylamino)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, Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4'-(2-(diisopropylamino)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 Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride?
The CAS number of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride is 20809-29-4.
What is the molecular formula of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride?
The molecular formula of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride is C18H30ClNO2.
What is the molecular weight of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride?
The molecular weight of Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride is 327.20 g/mol.
Where can I buy Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride?
You can request a quote for Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 4'-(2-(diisopropylamino)ethoxy)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.