TL;DR: K1-Hydroperoxide (CAS 15576-39-3) is a chemical compound with molecular formula C31H46O4 and molecular weight 482.3396 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-hydroperoxy-3,7,11,15-tetramethylhexadec-1-enyl)-3-methylnaphthalene-1,4-dione
Also Known As: K1-Hydroperoxide, Vitamin K1 Hydroperoxide, 2-[(E)-3-hydroperoxy-3,7,11,15-tetramethylhexadec-1-enyl]-3-methylnaphthalene-1,4-dione
| Molecular Formula | C31H46O4 |
| Molecular Weight | 482.3396 g/mol |
| XLogP | 9.3 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 482.3396 Da |
| Heavy Atoms | 35 |
| Complexity | 749.0 |
| SMILES | CC1=C(C(=O)C2=CC=CC=C2C1=O)C=CC(C)(CCCC(C)CCCC(C)CCCC(C)C)OO |
| InChIKey | YUTUNMUCBDSKNC-UHFFFAOYSA-N |
The XLogP value of 9.3 indicates that K1-Hydroperoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for K1-Hydroperoxide. Following Lipinski's Rule of Five, K1-Hydroperoxide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of K1-Hydroperoxide is 15576-39-3.
The molecular formula of K1-Hydroperoxide is C31H46O4.
The molecular weight of K1-Hydroperoxide is 482.3396 g/mol.
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