Ethyldiethanolamine
TL;DR: Ethyldiethanolamine (CAS 139-87-7) is a chemical compound with molecular formula C6H15NO2 and molecular weight 133.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[ethyl(2-hydroxyethyl)amino]ethanol
Also Known As: N-Ethyldiethanolamine, Ethyldiethanolamine, Diethanolethylamine, 2,2'-(Ethylazanediyl)diethanol, ETHYL DIETHANOLAMINE
| Molecular Formula | C6H15NO2 |
|---|---|
| Molecular Weight | 133.11 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 133.11028 |
| Heavy Atoms | 9 |
| Complexity | 53.0 |
| Melting Point | -50 °C |
| Boiling Point | 247 degc C |
| Density | 1.0135 g/cu cm at 20 °C |
| Solubility | Very soluble in ethanol; slightly soluble in ethyl ether |
| Flash Point | 97.8 °C (138 °C) (Open cup) |
| Vapor Pressure | 0.00245 [mmHg] |
| Refractive Index | 1.4663 at 20 °C |
Chemical Identifiers
| CAS Number | 139-87-7 |
|---|---|
| SMILES | CCN(CCO)CCO |
| InChIKey | AKNUHUCEWALCOI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyldiethanolamine (CAS 139-87-7), with molecular formula C6H15NO2 and molecular weight 133.11 g/mol. IUPAC: 2-[ethyl(2-hydroxyethyl)amino]ethanol.
Chemical Property Profile of Ethyldiethanolamine
Property Insights of Ethyldiethanolamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyldiethanolamine. With a topological polar surface area (TPSA) of 43.7 Ų, Ethyldiethanolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyldiethanolamine has 2 hydrogen bond donor(s) and 3 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 Ethyldiethanolamine?
The CAS number of Ethyldiethanolamine is 139-87-7.
What is the molecular formula of Ethyldiethanolamine?
The molecular formula of Ethyldiethanolamine is C6H15NO2.
What is the molecular weight of Ethyldiethanolamine?
The molecular weight of Ethyldiethanolamine is 133.11 g/mol.
Where can I buy Ethyldiethanolamine?
You can request a quote for Ethyldiethanolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyldiethanolamine?
Yes, KEHONG BIO provides custom synthesis services for Ethyldiethanolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.