TL;DR: (S)-3-methyloxacyclotetradecan-2-one (CAS 1212342-55-6) is a chemical compound with molecular formula C14H26O2 and molecular weight 226.19328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-methyl-oxacyclotetradecan-2-one
Also Known As: (S)-3-methyloxacyclotetradecan-2-one, (3S)-3-methyl-oxacyclotetradecan-2-one
| Molecular Formula | C14H26O2 |
| Molecular Weight | 226.19328 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.19328 Da |
| Heavy Atoms | 16 |
| Complexity | 189.0 |
| SMILES | C[C@H]1CCCCCCCCCCCOC1=O |
| InChIKey | XAWSKPSSJADZMX-ZDUSSCGKSA-N |
The XLogP value of 5.3 indicates that (S)-3-methyloxacyclotetradecan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (S)-3-methyloxacyclotetradecan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-3-methyloxacyclotetradecan-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (S)-3-methyloxacyclotetradecan-2-one is 1212342-55-6.
The molecular formula of (S)-3-methyloxacyclotetradecan-2-one is C14H26O2.
The molecular weight of (S)-3-methyloxacyclotetradecan-2-one is 226.19328 g/mol.
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