trichlorogallium * ethanethiol
diethyl ether
A
galliumtrichloride * diethylether
B
ethanethiol
Conditions | Yield |
---|---|
In benzene under inert gas; 5.88 mmol Et2O added to 5.88 mmol of the Ga compound in benzene; stirring at room temp.; 2 phases sepd.; oily phase stirred with n-pentane and dried in vac.; elem. anal.; | A 99% B n/a |
Conditions | Yield |
---|---|
With NH3 | A 98.5% B n/a |
3α-(1,1-Bisethylthioethyl)-3β-hydroxy-14α-methyl-4-nor-5α-cholest-8-ene
A
3α-(1-Ethylthioethenyl)-3β-hydroxy-14α-methyl-4-nor-5α-cholest-8-ene
B
ethanethiol
Conditions | Yield |
---|---|
With copper(l) chloride In N,N-dimethyl-formamide at 50℃; for 0.166667h; | A 98% B n/a |
With copper(l) chloride In N,N-dimethyl-formamide at 50℃; for 0.166667h; other substrates; | A 98% B n/a |
trichlorogallium * ethanethiol
Trimethyl(methylthio)silane
A
chloro-trimethyl-silane
D
methylthiol
E
ethanethiol
Conditions | Yield |
---|---|
In benzene 4.62 mmol Me3SiSMe added to 4.62 mmol of the Ga compound in benzene; stirring at room temp.; filtration; solvent removed in vac.; elem. anal. (Cl2GaSC2H5); | A n/a B 98% C n/a D n/a E n/a |
trichlorogallium * ethanethiol
lead bis(methylthiolate)
C
methylthiol
D
ethanethiol
Conditions | Yield |
---|---|
In benzene 2.10 mmol Pb(SCH3)2 added to 4.20 mmol of the Ga compound in benzene; stirring at room temp.; filtration; solvent removed in vac.; residue washed with n-pentane and dried in vac.; elem. anal. (Cl2GaSC2H5); | A 98% B n/a C n/a D n/a E n/a |
isopentyl-dithiocarbamic acid ethyl ester
A
isopentyl isothiocyanate
B
ethanethiol
Conditions | Yield |
---|---|
at 250 - 260℃; | A 97% B n/a |
3β-(1,1-Bisethylthioethyl)-3α-hydroxy-14α-methyl-4-nor-5β-cholest-8-ene
A
3β-(1-Ethylthioethenyl)-3-α-hydroxy-14α-methyl-4-nor-5β-cholest-8-ene
B
ethanethiol
Conditions | Yield |
---|---|
With copper(l) chloride In N,N-dimethyl-formamide at 50℃; for 0.166667h; | A 97% B n/a |
(3R,5S,8R,9S,10S,13R,14S,17R)-3-(1,1-Bis-ethylsulfanyl-ethyl)-17-((R)-1,5-dimethyl-hexyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-ol
A
(3R,5S,8R,9S,10S,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-3-(1-ethylsulfanyl-vinyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-ol
B
ethanethiol
Conditions | Yield |
---|---|
With copper(l) chloride In N,N-dimethyl-formamide at 50℃; for 0.166667h; | A 97% B n/a |
methylthiol
ethene
A
dimethylsulfide
B
Ethyl methyl sulfide
C
diethyl sulphide
D
ethanethiol
Conditions | Yield |
---|---|
With 2,2-dimethoxy-2-phenylacetophenone at 45℃; under 2250.23 - 6750.68 Torr; for 14.1h; UV-irradiation; | A n/a B 97% C n/a D n/a |
trichlorogallium * ethanethiol
dimethylsulfide
A
galliumtrichloride * dimethylsulfide
B
ethanethiol
Conditions | Yield |
---|---|
In benzene under inert gas; 6.30 mmol Et2S added to 6.30 mmol of the Ga compound in benzene; stirring at room temp.; 2 phases sepd.; oily phase stirred with n-pentane and dried in vac.; elem. anal.; | A 97% B n/a |
aluminiumtrichloride*ethanediol
diethyl ether
A
aluminium trichloride-diethyl ether (1/1)
B
ethanethiol
Conditions | Yield |
---|---|
In benzene under inert gas; 4.24 mmol Et2O added to 4.23 mmol of the Al compound in benzene; stirring at room temp.; solvent evapd. in vac., residue washed with n-pentane and dried in vac.; elem. anal.; | A 97% B n/a |
Conditions | Yield |
---|---|
With tri-n-butyl-tin hydride In various solvent(s) under 0.0750075 Torr; Reduction; | 96% |
at 496℃; mit Naphtha-Daempfen; | |
With diethyl ether; sodium |
Methyldithiocarbamidsaeure-ethylester
A
methyl thioisocyanate
B
ethanethiol
Conditions | Yield |
---|---|
at 250 - 260℃; | A 96% B n/a |
(3S,5S,8R,9S,10S,13R,14S,17R)-3-(1,1-Bis-ethylsulfanyl-ethyl)-17-((R)-1,5-dimethyl-hexyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-ol
A
(3S,5S,8R,9S,10S,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-3-(1-ethylsulfanyl-vinyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-ol
B
ethanethiol
Conditions | Yield |
---|---|
With copper(l) chloride In N,N-dimethyl-formamide at 50℃; for 0.166667h; | A 96% B n/a |
aluminiumtrichloride*ethanediol
dimethylsulfide
A
aluminiumtrichloride * dimethylsulfide
B
ethanethiol
Conditions | Yield |
---|---|
In benzene under inert gas; 5.52 mmol Et2S added to 5.53 mmol of the Al compound in benzene; stirring at room temp.; solvent evapd. in vac.; residue washed with n-pentane and dried in vac.; elem. anal.; | A 96% B n/a |
diethyl dimethylphosphoramidodithioite
A
triethyl trithiophosphite
C
ethanethiol
Conditions | Yield |
---|---|
With water at 120 - 130℃; for 0.5h; | A 81% B 72% C 95% |
ethyl cyclohexyldithiocarbamate
A
ethanethiol
B
isothiocyanatocyclohexane
Conditions | Yield |
---|---|
at 250 - 260℃; | A 95% B 92% |
aluminiumtrichloride*ethanediol
trimethylamine
A
aluminiumtrichloride * trimethylamine
B
ethanethiol
Conditions | Yield |
---|---|
In benzene under inert gas; 6.06 mmol Me3N in benzene added to 6.04 mmol of the Al compound in benzene; stirring at room temp.; solvent removed in vac.; residue washed with n-pentane and dried in vac.; elem. anal.; | A 95% B n/a |
3,3-Bis-ethylsulfanyl-2-phenyl-butan-2-ol
A
3-Ethylsulfanyl-2-phenyl-but-3-en-2-ol
B
ethanethiol
Conditions | Yield |
---|---|
With copper(l) chloride In N,N-dimethyl-formamide at 50℃; for 0.166667h; | A 94% B n/a |
Conditions | Yield |
---|---|
In chloroform 1:1 mixt. stirred for 10 min; evapd., washed (Et2O), dried (vac.); NMR; | A 94% B n/a |
Conditions | Yield |
---|---|
at 250 - 260℃; | A 93% B n/a |
Conditions | Yield |
---|---|
at 250 - 260℃; | A 87% B 93% |
ethyl ethylselenosulfenate
ethanethiol
Conditions | Yield |
---|---|
With tri-n-butyl-tin hydride In various solvent(s) under 0.0750075 Torr; Reduction; | 92% |
Octyl-dithiocarbamic acid ethyl ester
A
n-octylisothiocyanate
B
ethanethiol
Conditions | Yield |
---|---|
at 250 - 260℃; | A 91% B n/a |
Propyl-dithiocarbamic acid ethyl ester
A
n-Propyl isothiocyanate
B
ethanethiol
Conditions | Yield |
---|---|
at 250 - 260℃; | A 89% B n/a |
triethyl trithiophosphite
benzoic acid
A
S-ethyl thiobenzoate
B
ethanethiol
Conditions | Yield |
---|---|
at 120 - 130℃; under 90 Torr; for 4h; Product distribution; | A 89% B 61% C n/a |
Conditions | Yield |
---|---|
With NH3 -70°C, then warming at room temp. 15 h; | A 89% B n/a |
Conditions | Yield |
---|---|
With ammonia | A 88.5% B n/a |
With NH3 | A 88.5% B n/a |
Hexyl-dithiocarbamic acid ethyl ester
A
n-hexyl isothiocyanate
B
ethanethiol
Conditions | Yield |
---|---|
at 250 - 260℃; | A 85% B n/a |
Conditions | Yield |
---|---|
With sodium hydroxide; water at 25 - 40℃; for 1h; Addition; | 100% |
With water | |
for 2h; Ambient temperature; |
Conditions | Yield |
---|---|
1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione In chloroform at 20℃; | 100% |
With air; iron(III) chloride; sodium iodide In acetonitrile for 0.116667h; Ambient temperature; | 98% |
With oxygen; SiO2-Cl In dichloromethane at 0℃; for 0.166667h; | 98% |
Conditions | Yield |
---|---|
With sodium hydroxide In methanol at 0 - 20℃; for 1h; | 100% |
(i) Na, liq. NH3, (ii) /BRN= 605309/; Multistep reaction; | |
With sodium ethanolate In ethanol |
Conditions | Yield |
---|---|
With sodium hydride In tetrahydrofuran at 25℃; | 100% |
With sodium hydride In tetrahydrofuran |
1,3-Dimethyl-6-chlorouracil
ethanethiol
6-Ethylsulfanyl-1,3-dimethyl-1H-pyrimidine-2,4-dione
Conditions | Yield |
---|---|
With sodium hydroxide; N-benzyl-N,N,N-triethylammonium chloride In dichloromethane; water for 2.5h; Ambient temperature; | 100% |
1,3-diphenylpropanedione
ethanethiol
3-ethylsulfanyl-1,3-diphenylprop-2-en-1-one
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid In benzene for 15h; Heating; | 100% |
1,2,4,6-tetra-O-acetyl-3-O-benzyl-β-D-glucopyranose
ethanethiol
ethyl 2,4,6-tri-O-acetyl-3-O-benzyl-1-thio-β-D-glucopyranoside
Conditions | Yield |
---|---|
With boron trifluoride diethyl etherate In dichloromethane for 2h; Ambient temperature; | 100% |
With molecular sieve; boron trifluoride diethyl etherate In dichloromethane for 2h; Ambient temperature; | 91% |
With trimethylsilyl trifluoromethanesulfonate; 4 A molecular sieve In dichloromethane at 0℃; for 2h; | 79% |
Conditions | Yield |
---|---|
With lithium hydroxide In N,N,N,N,N,N-hexamethylphosphoric triamide at 20℃; | 100% |
diethyl 2,4-dinitrobenzylidenemalonate
ethanethiol
Conditions | Yield |
---|---|
With triethylamine In tetrahydrofuran Ambient temperature; | 100% |
cis-2,6-dihydroxy-1,4-dioxathiane
ethanethiol
thiodiglycolaldehyde bis(diethyl dithioacetal)
Conditions | Yield |
---|---|
With hydrogenchloride at 0℃; for 0.5h; | 100% |
(S)-2-formylpyrrolidine-1-carboxylic acid benzyl ester
ethanethiol
benzyl (2S)-2-[di(ethylsulfanyl)methyl]tetrahydro-1H-1-pyrrolecarboxylate
Conditions | Yield |
---|---|
Stage #1: (S)-2-formylpyrrolidine-1-carboxylic acid benzyl ester; ethanethiol In chloroform for 0.5h; Inert atmosphere; Stage #2: With chloro-trimethyl-silane In chloroform at 20℃; Inert atmosphere; | 100% |
With chloro-trimethyl-silane In chloroform | 79% |
(3S,4R)-3-Hydroxy-1,4-dimethyl-5-oxo-3-((3aR,5S,7R,7aR)-2,2,7-trimethyl-tetrahydro-[1,3]dioxolo[4,5-b]pyran-5-yl)-pyrrolidine-2,2-dicarboxylic acid dimethyl ester
ethanethiol
(3R,3aS,4S,6aR)-4-((2R,3R)-4,4-Bis-ethylsulfanyl-3-hydroxy-2-methyl-butyl)-3a-hydroxy-1,3-dimethyl-2,6-dioxo-tetrahydro-furo[3,4-b]pyrrole-6a-carboxylic acid methyl ester
Conditions | Yield |
---|---|
With hydrogenchloride | 100% |
ethanethiol
Conditions | Yield |
---|---|
With N-ethyl-N,N-diisopropylamine In acetonitrile -78 deg C to RT; | 100% |
Conditions | Yield |
---|---|
In toluene for 20h; Ambient temperature; | 100% |
5-Methoxy-4-phenyl-5,6-dihydro-4H-[1,3,4]thiadiazine
ethanethiol
Conditions | Yield |
---|---|
Ambient temperature; | 100% |
1,1-dibromo-4-chloro-3,3-dimethyl-2-butanone
ethanethiol
4-chloro-1-(ethylthio)-3,3-dimethyl-2-butanone
Conditions | Yield |
---|---|
With sodium methylate In methanol for 1h; Ambient temperature; | 100% |
With sodium methylate 1.) MeOH, ice-cooling, 5 min, 2.) r.t., 1 h; Yield given; |
(S)-(-)-1,1-dimethylethyl <3-methyl-1-<<(methylsulfonyl)oxy>methyl>butyl>carbamate
ethanethiol
tert-butyl (S)-N-[1-(ethylsulfanylmethyl)-3-methylbutyl]carbamate
Conditions | Yield |
---|---|
With sodium hydride In tetrahydrofuran Heating; | 100% |
(2S)-2-[(tert-butoxycarbonyl)amino]-3-phenylpropyl methanesulfonate
ethanethiol
tert-butyl (S)-N-[1-(ethylsulfanylmethyl)-2-phenylethyl]carbamate
Conditions | Yield |
---|---|
With sodium hydride In tetrahydrofuran at 67℃; for 2h; | 100% |
Stage #1: ethanethiol With sodium hydride In tetrahydrofuran at 20℃; for 1h; Stage #2: (2S)-2-[(tert-butoxycarbonyl)amino]-3-phenylpropyl methanesulfonate In tetrahydrofuran at 20℃; for 12h; |
(R)-1-<(1,1-dimethylethoxy)carbonyl>-2-pyrrolidinemethanolmethanesulfonate
ethanethiol
Conditions | Yield |
---|---|
With sodium hydride In tetrahydrofuran Heating; | 100% |
(S)-2-[ (tert-butoxycarbonyl)-amino]-3-(4-methoxyphenyl)-propylmethanesulfonate
ethanethiol
[(S)-1-Ethylsulfanylmethyl-2-(4-methoxy-phenyl)-ethyl]-carbamic acid tert-butyl ester
Conditions | Yield |
---|---|
With sodium hydride In tetrahydrofuran for 2h; Heating; | 100% |
4-((S)-2-tert-Butoxycarbonylamino-3-methanesulfonyloxy-propyl)-imidazole-1-carboxylic acid tert-butyl ester
ethanethiol
[(S)-1-Ethylsulfanylmethyl-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid tert-butyl ester
Conditions | Yield |
---|---|
With sodium hydride In tetrahydrofuran Heating; | 100% |
ethanethiol
Conditions | Yield |
---|---|
With potassium carbonate In N,N-dimethyl-formamide at 60℃; | 100% |
ethylene dibromide
ethanethiol
2,2'-ethane-1,2-diylbissulfanyl-bis-ethanol
Conditions | Yield |
---|---|
With sodium ethanolate In ethanol for 1h; Heating; | 100% |
N-propargyl-2,4-bis(trifluoroacetyl)-1-naphthylamine
ethanethiol
Conditions | Yield |
---|---|
With sodium ethanolate In ethanol for 24h; Ambient temperature; | 100% |
(-)-(4S,5R,2'S,3'R)-3-(3-hydroxy-2-methylbutanoyl)-4-methyl-5-phenyl-1,3-oxazolidin-2-one
ethanethiol
A
(4S,5R)-4-methyl-5-phenyl-oxazolidin-2-one
B
(+)-S-ethyl (2S,3R)-3-hydroxy-2-methylbutanethioate
Conditions | Yield |
---|---|
With n-butyllithium In tetrahydrofuran; hexane at -78℃; for 0.5h; Substitution; | A 100% B 99% |
Conditions | Yield |
---|---|
In dichloromethane at 20℃; for 48h; Addition; Michael addition; | 100% |
ethanethiol
2-{6-[7-(4-benzyl-2-oxo-oxazolidine-3-carbonyl)-4-(tert-butyl-dimethyl-silanyloxy)-1-(4-methoxy-benzyloxy)-5,9-dimethyl-6-oxo-undec-10-ynyl]-2-methoxy-4-methoxycarbonylmethylene-tetrahydro-pyran-2-yl}-propionic acid benzyl ester
Conditions | Yield |
---|---|
With potassium hydride In tetrahydrofuran at 25℃; for 3h; | 100% |
ethanethiol
Conditions | Yield |
---|---|
With trimethylsilyl trifluoromethanesulfonate; 4 A molecular sieve In dichloromethane at 0℃; for 1.08333h; Substitution; | 100% |
Conditions | Yield |
---|---|
Stage #1: ethanethiol With sodium hydroxide In water at 20℃; for 0.5h; Stage #2: 2-chloro-benzaldehyde With tetrabutylammomium bromide In water at 82℃; | 100% |
With tetrabutylammomium bromide; sodium hydroxide In water at 82℃; for 4 - 6h; | 95% |
With sodium carbonate In N,N-dimethyl-formamide at 100℃; for 24h; | 80% |
Stage #1: ethanethiol With sodium hydroxide In water for 1h; Stage #2: 2-chloro-benzaldehyde With tetrabutylammomium bromide In water for 4h; Reflux; |
Conditions | Yield |
---|---|
Stage #1: ethanethiol With sodium tetrahydroborate; sodium hydroxide In water at 5℃; Inert atmosphere; Stage #2: isopropyl bromide; tetrabutylammomium bromide In water at 50℃; Inert atmosphere; | 100% |
With potassium hydroxide In ethanol for 0.5h; Heating; | 51% |
The Ethanethiol, with the CAS registry number 75-08-1 and EINECS registry number 200-837-3, has the systemtic name and IUPAC name of ethanethiol. It is a kind of colourless liquid with a strongly disagreeable odor which resembles that of leeks or onions. And the molecular formula of this chemical is C2H6S.What's more ,Its systematic name is Ethanethiol.The presence of S in the structure leads to many different properties, most notably the infamous odour of EtSH. And it is also more volatile than ethanol because of a diminished ability to engage in hydrogen bonding. Therefore, it it can be added to otherwise odourless gas products such as liquefied petroleum gas (LPG) to help warn of gas leaks, of course, it is not harmful at these concentrations.
The physical properties of Ethanethiol are as followings:
(1)ACD/LogP: 1.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.442; (4)ACD/LogD (pH 7.4): 1.441; (5)ACD/BCF (pH 5.5): 7.339; (6)ACD/BCF (pH 7.4): 7.333; (7)ACD/KOC (pH 5.5): 144.953; (8)ACD/KOC (pH 7.4): 144.847; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.8 Å2; (13)Index of Refraction: 1.422; (14)Molar Refractivity: 19.211 cm3; (15)Molar Volume: 75.597 cm3; (16)Polarizability: 7.616×10-24cm3; (17)Surface Tension: 21.924 dyne/cm; (18)Density: 0.822 g/cm3; (19)Enthalpy of Vaporization: 26.79 kJ/mol; (20)Boiling Point: 34.663 °C at 760 mmHg; (21)Vapour Pressure: 537.074 mmHg at 25°C.
Preparation of Ethanethiol:
It can be prepared by absolute ethyl alcohol, fuming sulfuric acid and sodium hydrosulfide.
C2H5OH+H2SO4.SO3→C2H5OSO2OH+H2SO4
2C2H5OSO2OH+Na2CO3→2C2H5OSO2ONa+H2O+CO2↑
C2H5OSO2ONa+NaSH→C2H5SH+Na2SO4
Uses of Ethanethiol:
It is often used as pesticide intermediates and air alert. And it is also used as stabilizer in the adhesives and intermediates in organic synthesis.
Safety information of Ethanethiol:
You should be cautious while dealing with this chemical. It is a kind of flammble chemcial which is very toxic to aquatic organisms, and may cause long-term adverse effects in the aquatic environment. It is also harmful by inhalation. Therefore, you had better take the following instructions: Keep away from sources of ignition - No smoking; Avoid contact with eyes; This material and/or its container must be disposed of as hazardous waste; Avoid release to the environment. Refer to special instructions safety data sheet.
You can still convert the following datas into molecular structure:
(1)SMILES: CCS
(2)InChI: InChI=1/C2H6S/c1-2-3/h3H,2H2,1H3
(3)InChIKey: DNJIEGIFACGWOD-UHFFFAOYAW
The toxicity data of Ethanethiol is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LC50 | inhalation | 2770ppm/4H (2770ppm) | BEHAVIORAL: EXCITEMENT BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) LUNGS, THORAX, OR RESPIRATION: CYANOSIS | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
rat | LC50 | inhalation | 4420ppm/4H (4420ppm) | PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE BEHAVIORAL: EXCITEMENT LUNGS, THORAX, OR RESPIRATION: CYANOSIS | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
rat | LD50 | intraperitoneal | 226mg/kg (226mg/kg) | BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: CYANOSIS | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
rat | LD50 | oral | 682mg/kg (682mg/kg) | BEHAVIORAL: MUSCLE WEAKNESS BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: CYANOSIS | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
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