TL;DR: 3-O-Dodecylcarbomethylascorbic acid (CAS 133794-57-7) is a chemical compound with molecular formula C20H34O7 and molecular weight 386.23044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-3-(2-oxotetradecoxy)-2H-furan-5-one
Also Known As: 3-O-Dodecylcarbomethylascorbic acid, 3-O-Dodecylcarbomethyl-L-ascorbic acid, 3-O-DODECYLCARBOMETHYLASCORBICACID, 3-O-(2-Oxotetradecyl)-L-ascorbic acid, (2R)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-3-(2-oxotetradecoxy)-2H-furan-5-one
| Molecular Formula | C20H34O7 |
| Molecular Weight | 386.23044 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 16 |
| Exact Mass | 386.23044 Da |
| Heavy Atoms | 27 |
| Complexity | 487.0 |
| SMILES | CCCCCCCCCCCCC(=O)COC1=C(C(=O)O[C@@H]1[C@H](CO)O)O |
| InChIKey | MUSWYBCUWOLKQJ-FUHWJXTLSA-N |
The XLogP value of 4.0 indicates that 3-O-Dodecylcarbomethylascorbic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-O-Dodecylcarbomethylascorbic acid. Following Lipinski's Rule of Five, 3-O-Dodecylcarbomethylascorbic acid has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-O-Dodecylcarbomethylascorbic acid is 133794-57-7.
The molecular formula of 3-O-Dodecylcarbomethylascorbic acid is C20H34O7.
The molecular weight of 3-O-Dodecylcarbomethylascorbic acid is 386.23044 g/mol.
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