Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
TL;DR: Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) (CAS 60789-80-2) is a chemical compound with molecular formula C24H53N3O7 and molecular weight 495.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(N,N-diethylethanamine);2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: Triethylamine citrate, C6H15N.1/3C6H8O7, Citric acid, tris(triethylamine) salt, C6-H15-N.1/3C6-H8-O7, Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
| Molecular Formula | C24H53N3O7 |
|---|---|
| Molecular Weight | 495.39 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Exact Mass | 495.38834 |
| Heavy Atoms | 34 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 60789-80-2 |
|---|---|
| SMILES | CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | WORLLILUGHBXRR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) (CAS 60789-80-2), with molecular formula C24H53N3O7 and molecular weight 495.39 g/mol. IUPAC: tris(N,N-diethylethanamine);2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
Property Insights of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1). The TPSA of 142.0 Ų indicates high polarity, suggesting Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) has 4 hydrogen bond donor(s) and 10 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 Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)?
The CAS number of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) is 60789-80-2.
What is the molecular formula of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)?
The molecular formula of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) is C24H53N3O7.
What is the molecular weight of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)?
The molecular weight of Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) is 495.39 g/mol.
Where can I buy Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)?
You can request a quote for Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1)?
Yes, KEHONG BIO provides custom synthesis services for Ethanamine, N,N-diethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (3:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.