1,4-Bis(2-(dimethylamino)ethyl) butanedioate
TL;DR: 1,4-Bis(2-(dimethylamino)ethyl) butanedioate (CAS 19249-04-8) is a chemical compound with molecular formula C12H24N2O4 and molecular weight 260.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(dimethylamino)ethyl] butanedioate
Also Known As: Bis(2-(dimethylamino)ethyl) succinate, Choline Impurity 3, bis[2-(dimethylamino)ethyl] succinate, Succinylcholine Impurity 1, bis[2-(dimethylamino)ethyl] butanedioate
| Molecular Formula | C12H24N2O4 |
|---|---|
| Molecular Weight | 260.17 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 260.1736 |
| Heavy Atoms | 18 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 19249-04-8 |
|---|---|
| SMILES | CN(C)CCOC(=O)CCC(=O)OCCN(C)C |
| InChIKey | JSINVKLVDNFTSU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Bis(2-(dimethylamino)ethyl) butanedioate (CAS 19249-04-8), with molecular formula C12H24N2O4 and molecular weight 260.17 g/mol. IUPAC: bis[2-(dimethylamino)ethyl] butanedioate.
Chemical Property Profile of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate
Property Insights of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis(2-(dimethylamino)ethyl) butanedioate. With a topological polar surface area (TPSA) of 59.1 Ų, 1,4-Bis(2-(dimethylamino)ethyl) butanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(2-(dimethylamino)ethyl) butanedioate has 0 hydrogen bond donor(s) and 6 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 1,4-Bis(2-(dimethylamino)ethyl) butanedioate?
The CAS number of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate is 19249-04-8.
What is the molecular formula of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate?
The molecular formula of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate is C12H24N2O4.
What is the molecular weight of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate?
The molecular weight of 1,4-Bis(2-(dimethylamino)ethyl) butanedioate is 260.17 g/mol.
Where can I buy 1,4-Bis(2-(dimethylamino)ethyl) butanedioate?
You can request a quote for 1,4-Bis(2-(dimethylamino)ethyl) butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(2-(dimethylamino)ethyl) butanedioate?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(2-(dimethylamino)ethyl) butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.