RefChem:186682
TL;DR: RefChem:186682 (CAS 65121-96-2) is a chemical compound with molecular formula C6H17NO6S and molecular weight 231.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-hydroxyethyl(methyl)amino]ethanol;methyl hydrogen sulfate
Also Known As: Bis(2-hydroxyethyl)methylammonium methyl sulphate, methyl hydrogen sulfate- 2,2'-(methylimino)diethanol(1:1), Sulfuric acid, monomethyl ester, compd. with 2,2'-(methylimino)bis[ethanol] (1:1), 2-[2-hydroxyethyl(methyl)amino]ethanol; methyl hydrogen sulfate, Sulfuric acid, monomethyl ester, compd. with 2,2'-(methylimino)bis(ethanol) (1:1)
| Molecular Formula | C6H17NO6S |
|---|---|
| Molecular Weight | 231.08 g/mol |
| LogP | -1.66 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 231.07765 |
| Heavy Atoms | 14 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 65121-96-2 |
|---|---|
| SMILES | CN(CCO)CCO.COS(=O)(=O)O |
| InChIKey | SOBYTUYXBBGSHH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:186682 (CAS 65121-96-2), with molecular formula C6H17NO6S and molecular weight 231.08 g/mol. IUPAC: 2-[2-hydroxyethyl(methyl)amino]ethanol;methyl hydrogen sulfate.
Chemical Property Profile of RefChem:186682
Property Insights of RefChem:186682
The XLogP value of -1.66 indicates that RefChem:186682 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:186682. Following Lipinski's Rule of Five, RefChem:186682 has 3 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 RefChem:186682?
The CAS number of RefChem:186682 is 65121-96-2.
What is the molecular formula of RefChem:186682?
The molecular formula of RefChem:186682 is C6H17NO6S.
What is the molecular weight of RefChem:186682?
The molecular weight of RefChem:186682 is 231.08 g/mol.
Where can I buy RefChem:186682?
You can request a quote for RefChem:186682 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:186682?
Yes, KEHONG BIO provides custom synthesis services for RefChem:186682 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.