TL;DR: Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony (CAS 15991-76-1) is a chemical compound with molecular formula C51H102N3S6Sb and molecular weight 1069.5436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
antimony(3+);tris(N,N-bis(2-ethylhexyl)carbamodithioate)
Also Known As: Antimony tris(bis(2-ethylhexyl)dithiocarbamate), Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony, Antimony tris[bis(2-ethylhexyl)dithiocarbamate], antimony(3+); N,N-bis(2-ethylhexyl)carbamodithioate, Tris(bis(2-ethylhexyl)dithiocarbamato-S,S')antimony
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C51H102N3S6Sb |
| Molecular Weight | 1069.5436 g/mol |
| XLogP | 16.28 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 36 |
| Exact Mass | 1069.5436 Da |
| Heavy Atoms | 61 |
| Complexity | 220.0 |
| SMILES | CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].[Sb+3] |
| InChIKey | FPLFMZZKSXPSQO-UHFFFAOYSA-K |
The XLogP value of 16.28 indicates that Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony. Following Lipinski's Rule of Five, Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony is 15991-76-1.
The molecular formula of Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony is C51H102N3S6Sb.
The molecular weight of Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony is 1069.5436 g/mol.
You can request a quote for Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Tris[bis(2-ethylhexyl)dithiocarbamato-S,S']antimony and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 15991-76-1. Our professional technical team will respond with pricing and lead time.