TL;DR: CID 109738 (CAS 68201-85-4) is a chemical compound with molecular formula C18H34O5S and molecular weight 362.2127 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-sulfooctadec-9-enoic acid
Also Known As: 9-Octadecenoic acid, 9-sulfo-
| Molecular Formula | C18H34O5S |
| Molecular Weight | 362.2127 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 362.2127 Da |
| Heavy Atoms | 24 |
| Complexity | 449.0 |
| SMILES | CCCCCCCCC=C(CCCCCCCC(=O)O)S(=O)(=O)O |
| InChIKey | JEXDTYLVDKNUPY-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that CID 109738 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CID 109738. Following Lipinski's Rule of Five, CID 109738 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of CID 109738 is 68201-85-4.
The molecular formula of CID 109738 is C18H34O5S.
The molecular weight of CID 109738 is 362.2127 g/mol.
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