Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium
TL;DR: Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium (CAS 61533-03-7) is a chemical compound with molecular formula C12H18NO2+ and molecular weight 208.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium
Also Known As: benzyl(2-methoxy-2-oxoethyl)dimethylazanium, benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium, Dimethyl(benzyl)(methoxycarbonylmethyl)aminium, J3.502.182E, benzyl-(methoxycarbonylmethyl)-dimethyl-azanium
| Molecular Formula | C12H18NO2+ |
|---|---|
| Molecular Weight | 208.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.13376 |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 61533-03-7 |
|---|---|
| SMILES | C[N+](C)(CC1=CC=CC=C1)CC(=O)OC |
| InChIKey | GELLYGSLYWRCPS-UHFFFAOYSA-N |
Product Overview
Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium (CAS 61533-03-7), with molecular formula C12H18NO2+ and molecular weight 208.13 g/mol. IUPAC: benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium.
Chemical Property Profile of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium
Property Insights of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium. With a topological polar surface area (TPSA) of 26.3 Ų, Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium has 0 hydrogen bond donor(s) and 2 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 Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium?
The CAS number of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium is 61533-03-7.
What is the molecular formula of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium?
The molecular formula of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium is C12H18NO2+.
What is the molecular weight of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium?
The molecular weight of Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium is 208.13 g/mol.
Where can I buy Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium?
You can request a quote for Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium?
Yes, KEHONG BIO provides custom synthesis services for Benzyl-(2-methoxy-2-oxoethyl)-dimethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.