2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)
TL;DR: 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) (CAS 106063-76-7) is a chemical compound with molecular formula C21H31NO10 and molecular weight 457.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[2-(diethylamino)ethoxy]phenoxy]propan-2-one;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: 1-(2-(2-(Diethylamino)ethoxy)phenoxy)propan-2-one citrate, 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), 1-[2-(2-diethylaminoethyloxy)phenoxy]propan-2-one; 2-hydroxypropane-1,2,3-tricarboxylic acid, 2-Hydroxypropane-1,2,3-tricarboxylic acid--1-{2-[2-(diethylamino)ethoxy]phenoxy}propan-2-one (1/1), RefChem:266027
| Molecular Formula | C21H31NO10 |
|---|---|
| Molecular Weight | 457.19 g/mol |
| LogP | 1.1265 |
| Topological Polar Surface Area | 170.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 457.1948 |
| Heavy Atoms | 32 |
| Complexity | 744.7022 |
Chemical Identifiers
| CAS Number | 106063-76-7 |
|---|---|
| SMILES | CCN(CC)CCOC1=CC=CC=C1OCC(=O)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Product Overview
2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) (CAS 106063-76-7), with molecular formula C21H31NO10 and molecular weight 457.19 g/mol. IUPAC: 1-[2-[2-(diethylamino)ethoxy]phenoxy]propan-2-one;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)
Property Insights of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)
The XLogP value of 1.1265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1). The TPSA of 170.9 Ų indicates high polarity, suggesting 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) has 4 hydrogen bond donor(s) and 8 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 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)?
The CAS number of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) is 106063-76-7.
What is the molecular formula of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)?
The molecular formula of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) is C21H31NO10.
What is the molecular weight of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)?
The molecular weight of 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) is 457.19 g/mol.
Where can I buy 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)?
You can request a quote for 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.