TL;DR: Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum (CAS 17476-43-6) is a chemical compound with molecular formula C22H44MoN2O2S4 and molecular weight 594.134 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dioxomolybdenum(2+);bis(N,N-dipentylcarbamodithioate)
Also Known As: Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum, dioxomolybdenum(2+) bis(dipentylcarbamodithioate), dioxomolybdenum(2+); N,N-dipentylcarbamodithioate, EINECS 241-491-3
| Molecular Formula | C22H44MoN2O2S4 |
| Molecular Weight | 594.134 g/mol |
| XLogP | 6.76 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 594.134 Da |
| Heavy Atoms | 31 |
| Complexity | 151.0 |
| SMILES | CCCCCN(CCCCC)C(=S)[S-].CCCCCN(CCCCC)C(=S)[S-].O=[Mo+2]=O |
| InChIKey | MODZGGCGRFZIDV-UHFFFAOYSA-L |
The XLogP value of 6.76 indicates that Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum. Following Lipinski's Rule of Five, Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum is 17476-43-6.
The molecular formula of Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum is C22H44MoN2O2S4.
The molecular weight of Bis(dipentyldithiocarbamato-S,S')dioxomolybdenum is 594.134 g/mol.
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