Isotox
1-dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane;naphthalen-1-yl N-methylcarbamate;2,2,2-trichloro-1,1-bis(4-chlorophenyl)ethanol
Also Known As: Isotox|Phosphorothioic acid, S-(2-(ethylsulfinyl)ethyl) O,O-dimethyl ester, mixt. with 4-chloro-alpha-(4-chlorophenyl)-alpha-(trichloromethyl)benzenemethanol and 1-naphthalenyl methylcarbamate|1-dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane; naphthalen-1-yl N-methylcarbamate; 2,2,2-trichloro-1,1-bis(4-chlorophenyl)ethanol
| Molecular Formula | C32H35Cl5NO7PS2 |
|---|---|
| Molecular Weight | 815.00354 g/mol |
| LogP | 10.0466 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 815.00354 |
| Monoisotopic Mass | 815.00354 |
| Heavy Atoms | 48 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 69847-99-0 |
|---|---|
| SMILES | CCS(=O)CCSP(=O)(OC)OC.CNC(=O)OC1=CC=CC2=CC=CC=C21.C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(Cl)(Cl)Cl)O)Cl |
| InChIKey | WQKUBYVAJCRFHF-UHFFFAOYSA-N |
Product Overview
Isotox (CAS 69847-99-0), with molecular formula C32H35Cl5NO7PS2 and molecular weight 815.00354 g/mol. IUPAC: 1-dimethoxyphosphorylsulfanyl-2-ethylsulfinylethane;naphthalen-1-yl N-methylcarbamate;2,2,2-trichloro-1,1-bis(4-chlorophenyl)ethanol.
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