TL;DR: strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate (CAS 125009-58-7) is a chemical compound with molecular formula C20H20F14O4Sr and molecular weight 678.0194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
strontium bis((Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate)
Also Known As: strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate, Bis(1,1,1,2,2,3,3-heptafluoro-7,7-dimethyloctane-4,6-dionato)strontium(II), IUPAC: 6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxo-oct-3-en-3-olate; Strontium(+2) Cation
| Molecular Formula | C20H20F14O4Sr |
| Molecular Weight | 678.0194 g/mol |
| XLogP | 4.9766 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 678.0194 Da |
| Heavy Atoms | 39 |
| Complexity | 858.0 |
| SMILES | CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.[Sr+2] |
| InChIKey | VQHJVBZHIFNAQC-SJGYQHGCSA-L |
The XLogP value of 4.9766 indicates that strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate. Following Lipinski's Rule of Five, strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate has 0 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate is 125009-58-7.
The molecular formula of strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate is C20H20F14O4Sr.
The molecular weight of strontium (Z)-6,6,7,7,8,8,8-heptafluoro-2,2-dimethyl-5-oxooct-3-en-3-olate is 678.0194 g/mol.
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