Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride
TL;DR: Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride (CAS 41296-95-1) is a chemical compound with molecular formula C16H27ClN2O2 and molecular weight 314.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-butoxyanilino)-2-oxoethyl]-diethylazanium chloride
Also Known As: C 3121, 4'-Butoxy-2-(diethylamino)acetanilide, hydrochloride, ACETANILIDE, 4'-BUTOXY-2-(DIETHYLAMINO)-, HYDROCHLORIDE, [2-(4-butoxyanilino)-2-oxoethyl]-diethylazanium chloride, Acetamide, N-(4-butoxyphenyl)-2-(diethylamino)-, monohydrochloride
| Molecular Formula | C16H27ClN2O2 |
|---|---|
| Molecular Weight | 314.18 g/mol |
| LogP | -1.27 |
| Topological Polar Surface Area | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 314.17612 |
| Heavy Atoms | 21 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 41296-95-1 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)NC(=O)C[NH+](CC)CC.[Cl-] |
| InChIKey | YJJBGRXZHGAIGV-UHFFFAOYSA-N |
Product Overview
Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride (CAS 41296-95-1), with molecular formula C16H27ClN2O2 and molecular weight 314.18 g/mol. IUPAC: [2-(4-butoxyanilino)-2-oxoethyl]-diethylazanium chloride.
Chemical Property Profile of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride
Property Insights of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride
The XLogP value of -1.27 indicates that Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride has 2 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 Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride?
The CAS number of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride is 41296-95-1.
What is the molecular formula of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride?
The molecular formula of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride is C16H27ClN2O2.
What is the molecular weight of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride?
The molecular weight of Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride is 314.18 g/mol.
Where can I buy Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride?
You can request a quote for Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Acetanilide, 4'-butoxy-2-(diethylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.