Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate
TL;DR: Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate (CAS 55077-26-4) is a chemical compound with molecular formula C16H25NO7S and molecular weight 375.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-acetyloxypropanoyloxy)ethyl-trimethylazanium;benzenesulfonate
Also Known As: 2-(2-(Acetyloxy)-1-oxopropoxy)-N,N,N-trimethylethanaminium benzenesulfonate, Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate, 2-(2-acetyloxypropanoyloxy)ethyl-trimethylazanium; benzenesulfonate, 2-{[2-(Acetyloxy)propanoyl]oxy}-N,N,N-trimethylethan-1-aminium benzenesulfonate, RefChem:339938
| Molecular Formula | C16H25NO7S |
|---|---|
| Molecular Weight | 375.14 g/mol |
| LogP | 0.7781 |
| Topological Polar Surface Area | 109.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.13516 |
| Heavy Atoms | 25 |
| Complexity | 650.81085 |
Chemical Identifiers
| CAS Number | 55077-26-4 |
|---|---|
| SMILES | CC(C(=O)OCC[N+](C)(C)C)OC(=O)C.C1=CC=C(C=C1)S(=O)(=O)[O-] |
Product Overview
Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate (CAS 55077-26-4), with molecular formula C16H25NO7S and molecular weight 375.14 g/mol. IUPAC: 2-(2-acetyloxypropanoyloxy)ethyl-trimethylazanium;benzenesulfonate.
Chemical Property Profile of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate
Property Insights of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate
The XLogP value of 0.7781 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate. The TPSA of 109.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate. Following Lipinski's Rule of Five, Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate has 0 hydrogen bond donor(s) and 7 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 Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate?
The CAS number of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate is 55077-26-4.
What is the molecular formula of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate?
The molecular formula of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate is C16H25NO7S.
What is the molecular weight of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate?
The molecular weight of Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate is 375.14 g/mol.
Where can I buy Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate?
You can request a quote for Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Ethanaminium, 2-(2-(acetyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.