Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride
TL;DR: Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride (CAS 1166-85-4) is a chemical compound with molecular formula C21H28ClNO3 and molecular weight 377.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-methylazanium chloride
Also Known As: Benzilyloxyethyldiethylmethylammonium chloride, Diethyl(2-hydroxyethyl)methylammonium chloride, benzilate, AMMONIUM, (2-BENZILOYLOXYETHYL)DIETHYLMETHYL-, CHLORIDE, Ethanaminium, N,N-diethyl-2-((hydroxydiphenylacetyl)oxy)-N-methyl-, chloride, Ammonium, diethyl(2-hydroxyethyl)methyl-, chloride, benzilate
| Molecular Formula | C21H28ClNO3 |
|---|---|
| Molecular Weight | 377.18 g/mol |
| LogP | -0.04 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 377.17578 |
| Heavy Atoms | 26 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 1166-85-4 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Cl-] |
| InChIKey | KQVQBPSOWVZVQD-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride (CAS 1166-85-4), with molecular formula C21H28ClNO3 and molecular weight 377.18 g/mol. IUPAC: diethyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-methylazanium chloride.
Chemical Property Profile of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride
Property Insights of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride
The XLogP value of -0.04 indicates that Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride has 1 hydrogen bond donor(s) and 4 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 Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride?
The CAS number of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride is 1166-85-4.
What is the molecular formula of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride?
The molecular formula of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride is C21H28ClNO3.
What is the molecular weight of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride?
The molecular weight of Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride is 377.18 g/mol.
Where can I buy Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride?
You can request a quote for Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (2-benziloyloxyethyl)diethylmethyl-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.