Benzyl-bis(2-hydroxyethyl)-methylazanium
TL;DR: Benzyl-bis(2-hydroxyethyl)-methylazanium (CAS 148981-13-9) is a chemical compound with molecular formula C12H20NO2+ and molecular weight 210.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-bis(2-hydroxyethyl)-methylazanium
Also Known As: benzyl-bis(2-hydroxyethyl)-methylazanium, Benzylbis(2-hydroxyethyl)methylaminium, benzylbis(2-hydroxyethyl)methylazanium, N,N-Bis(2-hydroxyethyl)-N-methylbenzenemethanaminium, Benzenemethanaminium, N,N-bis(2-hydroxyethyl)-N-methyl-
| Molecular Formula | C12H20NO2+ |
|---|---|
| Molecular Weight | 210.15 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.1494 |
| Heavy Atoms | 15 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 148981-13-9 |
|---|---|
| SMILES | C[N+](CCO)(CCO)CC1=CC=CC=C1 |
| InChIKey | TYORFRRVUWSPEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl-bis(2-hydroxyethyl)-methylazanium (CAS 148981-13-9), with molecular formula C12H20NO2+ and molecular weight 210.15 g/mol. IUPAC: benzyl-bis(2-hydroxyethyl)-methylazanium.
Chemical Property Profile of Benzyl-bis(2-hydroxyethyl)-methylazanium
Property Insights of Benzyl-bis(2-hydroxyethyl)-methylazanium
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl-bis(2-hydroxyethyl)-methylazanium. With a topological polar surface area (TPSA) of 40.5 Ų, Benzyl-bis(2-hydroxyethyl)-methylazanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl-bis(2-hydroxyethyl)-methylazanium has 2 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-bis(2-hydroxyethyl)-methylazanium?
The CAS number of Benzyl-bis(2-hydroxyethyl)-methylazanium is 148981-13-9.
What is the molecular formula of Benzyl-bis(2-hydroxyethyl)-methylazanium?
The molecular formula of Benzyl-bis(2-hydroxyethyl)-methylazanium is C12H20NO2+.
What is the molecular weight of Benzyl-bis(2-hydroxyethyl)-methylazanium?
The molecular weight of Benzyl-bis(2-hydroxyethyl)-methylazanium is 210.15 g/mol.
Where can I buy Benzyl-bis(2-hydroxyethyl)-methylazanium?
You can request a quote for Benzyl-bis(2-hydroxyethyl)-methylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl-bis(2-hydroxyethyl)-methylazanium?
Yes, KEHONG BIO provides custom synthesis services for Benzyl-bis(2-hydroxyethyl)-methylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.