3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-
TL;DR: 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- (CAS 106063-86-9) is a chemical compound with molecular formula C23H33NO10 and molecular weight 483.21045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-[2-[2-(diethylamino)ethoxy]phenoxy]pent-3-en-2-one;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: (Z)-3-(2-(2-(Diethylamino)ethoxy)phenoxy)-3-penten-2-one citrate (1:1), 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-, (Z)-3-[2-(2-diethylaminoethyloxy)phenoxy]pent-3-en-2-one; 2-hydroxypropane-1,2,3-tricarboxylic acid
Technical Specifications
| Molecular Formula | C23H33NO10 |
| Molecular Weight | 483.21045 g/mol |
| XLogP | 2.0303 |
| Topological Polar Surface Area (TPSA) | 171.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 14 |
| Exact Mass | 483.21045 Da |
| Heavy Atoms | 34 |
| Complexity | 564.0 |
| SMILES | CCN(CC)CCOC1=CC=CC=C1O/C(=C\C)/C(=O)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | AJLUDXKSGVACKS-PZTRBQFESA-N |
Chemical Property Profile of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-
Property Insights of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-
The XLogP value of 2.0303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-. The TPSA of 171.0 Ų indicates high polarity, suggesting 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-?
The CAS number of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- is 106063-86-9.
What is the molecular formula of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-?
The molecular formula of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- is C23H33NO10.
What is the molecular weight of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-?
The molecular weight of 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- is 483.21045 g/mol.
Where can I buy 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-?
You can request a quote for 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)-?
Yes, CoreyChem provides custom synthesis services for 3-Penten-2-one, 3-(2-(2-(diethylamino)ethoxy)phenoxy)-, citrate (1:1), (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.