TL;DR: Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]- (CAS 144879-25-4) is a chemical compound with molecular formula C22H34O6 and molecular weight 394.23553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
12-[2-(3-carboxypropoxy)phenoxy]dodecanoic acid
Also Known As: Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]-, 12-[2-(3-carboxypropoxy)phenoxy]dodecanoic Acid
| Molecular Formula | C22H34O6 |
| Molecular Weight | 394.23553 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 394.23553 Da |
| Heavy Atoms | 28 |
| Complexity | 412.0 |
| SMILES | C1=CC=C(C(=C1)OCCCCCCCCCCCC(=O)O)OCCCC(=O)O |
| InChIKey | MOVOPGPUBCSTSD-UHFFFAOYSA-N |
The XLogP value of 5.5 indicates that Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]-. Following Lipinski's Rule of Five, Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]- is 144879-25-4.
The molecular formula of Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]- is C22H34O6.
The molecular weight of Dodecanoic acid, 12-[2-(3-carboxypropoxy)phenoxy]- is 394.23553 g/mol.
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