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Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate
TL;DR: Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate (CAS 17027-68-8) is a chemical compound with molecular formula C12H21NO6 and molecular weight 275.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[bis(2-hydroxyethyl)amino]methylidene]propanedioate
Also Known As: diethyl 2-[[bis(2-hydroxyethyl)amino]methylidene]propanedioate, diethyl{[bis(2-hydroxyethyl)amino]methylidene}propanedioate, diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate, Propanedioicacid, 2-[[bis(2-hydroxyethyl)amino]methylene]-, 1,3-diethyl ester
| Molecular Formula | C12H21NO6 |
|---|---|
| Molecular Weight | 275.14 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 275.1369 |
| Heavy Atoms | 19 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 17027-68-8 |
|---|---|
| SMILES | CCOC(=O)C(=CN(CCO)CCO)C(=O)OCC |
| InChIKey | GLDVUKQTWPODFL-UHFFFAOYSA-N |
Product Overview
Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate (CAS 17027-68-8), with molecular formula C12H21NO6 and molecular weight 275.14 g/mol. IUPAC: diethyl 2-[[bis(2-hydroxyethyl)amino]methylidene]propanedioate.
Chemical Property Profile of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate
Property Insights of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate
The XLogP value of -0.1 indicates that Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate. Following Lipinski's Rule of Five, Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate has 2 hydrogen bond donor(s) and 7 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 Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate?
The CAS number of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate is 17027-68-8.
What is the molecular formula of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate?
The molecular formula of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate is C12H21NO6.
What is the molecular weight of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate?
The molecular weight of Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate is 275.14 g/mol.
Where can I buy Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate?
You can request a quote for Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl {[bis(2-hydroxyethyl)amino]methylidene}propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.