Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)
TL;DR: Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) (CAS 129320-09-8) is a chemical compound with molecular formula C18H33NO6 and molecular weight 359.23077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-but-2-enedioic acid;2-(dimethylamino)ethyl decanoate
Also Known As: 2-dimethylaminoethyl Decanoate, 2-(Dimethylamino)ethyl decanoate maleate (1:1), Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1), (E)-but-2-enedioic acid;2-(dimethylamino)ethyl decanoate, (E)-but-2-enedioic acid; 2-dimethylaminoethyl decanoate
Technical Specifications
| Molecular Formula | C18H33NO6 |
| Molecular Weight | 359.23077 g/mol |
| XLogP | 2.9437 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 359.23077 Da |
| Heavy Atoms | 25 |
| Complexity | 300.0 |
| SMILES | CCCCCCCCCC(=O)OCCN(C)C.C(=C/C(=O)O)\C(=O)O |
| InChIKey | CAZDVHIUPQWANE-WLHGVMLRSA-N |
Chemical Property Profile of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)
Property Insights of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)
The XLogP value of 2.9437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1). The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1). Following Lipinski's Rule of Five, Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) 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
What is the CAS number of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)?
The CAS number of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) is 129320-09-8.
What is the molecular formula of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)?
The molecular formula of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) is C18H33NO6.
What is the molecular weight of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)?
The molecular weight of Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) is 359.23077 g/mol.
Where can I buy Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)?
You can request a quote for Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)?
Yes, CoreyChem provides custom synthesis services for Decanoic acid, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.