Abol-X
TL;DR: Abol-X (CAS 107959-15-9) is a chemical compound with molecular formula C12H18Cl6N5O2PS2 and molecular weight 568.8771 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(dimethoxyphosphinothioylsulfanylmethyl)-1,3,5-triazine-2,4-diamine;1,2,3,4,5,6-hexachlorocyclohexane
Also Known As: Abol-X, 6-(dimethoxyphosphinothioylsulfanylmethyl)-1,3,5-triazine-2,4-diamine;1,2,3,4,5,6-hexachlorocyclohexane, 6-(dimethoxyphosphinothioylsulfanylmethyl)-1,3,5-triazine-2,4-diamine; 1,2,3,4,5,6-hexachlorocyclohexane, Phosphorodithioic acid, S-((4,6-diamino-1,3,5-triazin-2-yl)methyl) O,O-dimethyl ester, mixt. with (1alpha,2alpha,3beta,4alpha,5alpha,6beta)-1,2,3,4,5,6-hexachlorocyclohexane, Phosphorodithioic acid, S-[(4,6-diamino-1,3,5-triazin-2-yl)methyl] O,O-dimethyl ester, mixt. with (1.alpha.,2.alpha.,3.beta.,4.alpha.,5.alpha.,6.beta.)-1,2,3,4,5,6-hexachlorocyclohexane
Technical Specifications
| Molecular Formula | C12H18Cl6N5O2PS2 |
| Molecular Weight | 568.8771 g/mol |
| XLogP | 4.4309 |
| Topological Polar Surface Area (TPSA) | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 568.8771 Da |
| Heavy Atoms | 28 |
| Complexity | 357.0 |
| SMILES | COP(=S)(OC)SCC1=NC(=NC(=N1)N)N.C1(C(C(C(C(C1Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | HILBFYBSIOQXBC-UHFFFAOYSA-N |
Chemical Property Profile of Abol-X
Property Insights of Abol-X
The XLogP value of 4.4309 indicates that Abol-X is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting Abol-X may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Abol-X has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Abol-X?
The CAS number of Abol-X is 107959-15-9.
What is the molecular formula of Abol-X?
The molecular formula of Abol-X is C12H18Cl6N5O2PS2.
What is the molecular weight of Abol-X?
The molecular weight of Abol-X is 568.8771 g/mol.
Where can I buy Abol-X?
You can request a quote for Abol-X directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Abol-X?
Yes, CoreyChem provides custom synthesis services for Abol-X and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.