TL;DR: Tetradecyl heptanoate (CAS 29710-33-6) is a chemical compound with molecular formula C21H42O2 and molecular weight 326.31848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tetradecyl heptanoate
Also Known As: Tetradecyl heptanoate, tetradecylheptanoate, Heptanoic acid tetradecyl ester, Heptanoic acid,tetradecyl ester, EINECS 249-795-8
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H42O2 |
| Molecular Weight | 326.31848 g/mol |
| XLogP | 9.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 326.31848 Da |
| Heavy Atoms | 23 |
| Complexity | 238.0 |
| SMILES | CCCCCCCCCCCCCCOC(=O)CCCCCC |
| InChIKey | IRYILAALKRHYJL-UHFFFAOYSA-N |
The XLogP value of 9.2 indicates that Tetradecyl heptanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Tetradecyl heptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetradecyl heptanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tetradecyl heptanoate is 29710-33-6.
The molecular formula of Tetradecyl heptanoate is C21H42O2.
The molecular weight of Tetradecyl heptanoate is 326.31848 g/mol.
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