Dimethyldiethanolammonium
TL;DR: Dimethyldiethanolammonium (CAS 5431-74-3) is a chemical compound with molecular formula C6H16NO2+ and molecular weight 134.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-hydroxyethyl)-dimethylazanium
Also Known As: Dimethyldiethanolammonium, n,n-dimethyldiethanolamine, Dimethyl diethanolammonium, Bis(2-hydroxyethyl)dimethylammonium, bis(2-hydroxyethyl)-dimethylazanium
| Molecular Formula | C6H16NO2+ |
|---|---|
| Molecular Weight | 134.12 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 134.1181 |
| Heavy Atoms | 9 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 5431-74-3 |
|---|---|
| SMILES | C[N+](C)(CCO)CCO |
| InChIKey | FIVJMCNNMIGYRO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyldiethanolammonium (CAS 5431-74-3), with molecular formula C6H16NO2+ and molecular weight 134.12 g/mol. IUPAC: bis(2-hydroxyethyl)-dimethylazanium.
Chemical Property Profile of Dimethyldiethanolammonium
Property Insights of Dimethyldiethanolammonium
The XLogP value of -1.1 indicates that Dimethyldiethanolammonium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, Dimethyldiethanolammonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyldiethanolammonium 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 Dimethyldiethanolammonium?
The CAS number of Dimethyldiethanolammonium is 5431-74-3.
What is the molecular formula of Dimethyldiethanolammonium?
The molecular formula of Dimethyldiethanolammonium is C6H16NO2+.
What is the molecular weight of Dimethyldiethanolammonium?
The molecular weight of Dimethyldiethanolammonium is 134.12 g/mol.
Where can I buy Dimethyldiethanolammonium?
You can request a quote for Dimethyldiethanolammonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyldiethanolammonium?
Yes, KEHONG BIO provides custom synthesis services for Dimethyldiethanolammonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.