Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)
TL;DR: Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) (CAS 129320-22-5) is a chemical compound with molecular formula C22H31ClN2O13 and molecular weight 566.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(dimethylamino)ethyl] 2-(4-chlorophenoxy)butanedioate;oxalic acid
Also Known As: Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2), Butanedioic acid, (4-chlorophenoxy)-, bis(2-(dimethylamino)ethyl) ester, ethanedioate (1:2), Bis(2-dimethylaminoethyl) 2-(4-chlorophenoxy)butanedioate, bis[2-(dimethylamino)ethyl] 2-(4-chlorophenoxy)butanedioate,, bis(2-dimethylaminoethyl) 2-(4-chlorophenoxy)butanedioate; oxalic acid
| Molecular Formula | C22H31ClN2O13 |
|---|---|
| Molecular Weight | 566.15 g/mol |
| LogP | -0.0017 |
| Topological Polar Surface Area | 217.51 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 566.1515 |
| Heavy Atoms | 38 |
| Complexity | 872.32635 |
Chemical Identifiers
| CAS Number | 129320-22-5 |
|---|---|
| SMILES | CN(C)CCOC(=O)CC(C(=O)OCCN(C)C)OC1=CC=C(C=C1)Cl.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
Product Overview
Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) (CAS 129320-22-5), with molecular formula C22H31ClN2O13 and molecular weight 566.15 g/mol. IUPAC: bis[2-(dimethylamino)ethyl] 2-(4-chlorophenoxy)butanedioate;oxalic acid.
Chemical Property Profile of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)
Property Insights of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)
The XLogP value of -0.0017 indicates that Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 217.51 Ų indicates high polarity, suggesting Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)?
The CAS number of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) is 129320-22-5.
What is the molecular formula of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)?
The molecular formula of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) is C22H31ClN2O13.
What is the molecular weight of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)?
The molecular weight of Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) is 566.15 g/mol.
Where can I buy Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)?
You can request a quote for Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-(dimethylamino)ethyl) (4-chlorophenoxy)butanedioate ethanedioate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.