Propanoic acid, 2-methyl-2-[(phenylthioxomethyl)thio]-, ethyl ester
ethyl 2-(benzenecarbonothioylsulfanyl)-2-methylpropanoate
Also Known As: ECPDB|starbld0042898|Ethyl 2-methyl-2-((phenylcarbonothioyl)thio)propanoate|Propanoic acid, 2-methyl-2-[(phenylthioxomethyl)thio]-, ethyl ester|Ethyl 2-methyl-2-(phenylthiocarbonylthio)propionate|2-(ethoxycarbonyl)prop-2-yl dithiobenzoate|2-(ETHOXYCARBONYL)-2-PROPYLDITHIOBENZOATE|J1.367.752B|2-(Ethoxycarbonyl)-2-propyldithiobenzoate,ECPDB|ethyl 2-(benzenecarbonothioylsulfanyl)-2-methylpropanoate|ETHYL 2-(BENZENECARBOTHIOYLSULFANYL)-2-METHYLPROPANOATE|Ethyl 2-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate|2-(alpha-Thioxobenzylthio)isobutyric acid ethyl ester|2-(Thiobenzoylthio)-2-methylpropanoic acid ethyl ester|2-Methyl-2-(thiobenzoylthio)propanoic acid ethyl ester|Dithiobenzoic acid 1-methyl-1-ethoxycarbonylethyl ester|Dithiobenzoic acid 2-(ethoxycarbonyl)propane-2-yl ester|Dithiobenzoic acid 1-(ethoxycarbonyl)-1-methylethyl ester|Dithiobenzoic acid 1-methyl-1-(ethoxycarbonyl)ethyl ester|Ethyl 2-[(benzenecarbothioyl)sulfanyl]-2-methylpropanoate|Ethyl 2-methyl-2-(phenylthiocarbonylthio)propionate, 95%|2-(alpha-Thioxobenzylthio)-2-methylpropionic acid ethyl ester|2-Methyl-2-(phenylcarbonothioylthio)propionic acid ethyl ester|2-Methyl-2-[phenyl(thiocarbonyl)thio]propanoic acid ethyl ester|N/A
| Molecular Formula | C13H16O2S2 |
|---|---|
| Molecular Weight | 268.05917 g/mol |
| LogP | 3.437 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.05917 |
| Monoisotopic Mass | 268.05917 |
| Heavy Atoms | 17 |
| Complexity | 399.14032 |
Chemical Identifiers
| CAS Number | 201611-84-9 |
|---|---|
| SMILES | CCOC(=O)C(C)(C)SC(=S)C1=CC=CC=C1 |
Product Overview
Propanoic acid, 2-methyl-2-[(phenylthioxomethyl)thio]-, ethyl ester (CAS 201611-84-9), with molecular formula C13H16O2S2 and molecular weight 268.05917 g/mol. IUPAC: ethyl 2-(benzenecarbonothioylsulfanyl)-2-methylpropanoate.