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Name |
Ethylicin |
EINECS | N/A |
CAS No. | 682-91-7 | Density | 1.19 g/cm3 |
PSA | 67.82000 | LogP | 2.17000 |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H10O2S2 | Boiling Point | 283.7 °C at 760 mmHg |
Molecular Weight | 154.254 | Flash Point | 125.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Ethanesulfonicacid, thio-, S-ethyl ester (6CI,7CI,8CI);Ethanethiol, ethanesulfonate(6CI,8CI);Ethanethiosulfonic acid ethyl ester;Ethyl ethanethiosulfonate;NSC22422;Pseudoallicin 150;S-Ethyl ethanethiosulfonate; |
Article Data | 4 |
The Ethylicin with the cas number 682-91-7 is also called ethanesulfonothioic acid, S-ethyl ester. The systematic name is S-ethyl ethanesulfonothioate. Its molecular formula is C4H10O2S2. The product's category is FUNGICIDE.
The properties of the chemical are: (1)ACD/LogP: 1.32; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 67.82 Å2; (7)Index of Refraction: 1.488; (8)Molar Refractivity: 37.39 cm3; (9)Molar Volume: 129.5 cm3; (10)Polarizability: 14.82×10-24cm3; (11)Surface Tension: 39.6 dyne/cm ; (12)Enthalpy of Vaporization: 50.17 kJ/mol; (13)Vapour Pressure: 0.00533 mmHg at 25°C.
Preparation: This chemical can be prepared by ethanesulfinyl chloride. This reaction needs reagent diethyl ether and zinc.
Uses: This chemical can react with dithioacetic acid methyl ester, to product ethylsulfanyl-dithioacetic acid methyl ester. This reaction needs reagent sodium amide and liquid ammonia. The yield is 80%.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(SCC)CC
(2)InChI: InChI=1/C4H10O2S2/c1-3-7-8(5,6)4-2/h3-4H2,1-2H3
(3)InChIKey: OICGFSUWXCJLCO-UHFFFAOYAZ