Methyl thioglycolate supplier

Name
Methyl thioglycolate
EINECS 219-121-7
CAS No. 2365-48-2
Article Data23
CAS DataBase
Density 1.187
Solubility 40 g/L (20 ºC) in water
Melting Point -24 ºC
Formula C₃H₆ O₂S
Boiling Point 42-43 ºC (10 mmHg)
Molecular Weight 106.145
Flash Point 56 ºC
Transport Information UN 1992 3/PG 3
Appearance colorless or palegreen liquid
Safety Poison by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of SO_x. See also MERCAPTANS and ESTERS.
Risk Codes R10;R20/22;R25;R36/37/38
Molecular Structure
Hazard Symbols
Synonyms Acetic acid,mercapto-, methyl ester (6CI,7CI,8CI,9CI);2-Mercaptoacetic acid methyl ester;Mercaptoacetic acid methyl ester;Methyl 2-mercaptoacetate;Methylmercaptoacetate;Methyl thioglycolate;Methyl a-mercaptoacetate;NSC 75117;Thioglycolic acid methylester;
PSA 65.10000
LogP 0.08920

Synthetic route

: 67-56-1
methanol

: 68-11-1
mercaptoacetic acid

: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With sulfuric acid for 4h; Reflux;	95%
With sulfuric acid for 4h; Reflux;	94%
at 40℃; for 3h; Temperature;	88.74%

: 84495-75-0
(N-Phenyl-formimidoylsulfanyl)-acetic acid methyl ester

A: 68-11-1
mercaptoacetic acid

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With hydrogenchloride In water Ambient temperature;	A 3% B 93%

: 1665-64-1
methyl bis(thioacetate)

: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With magnesium In methanol for 2h; Ambient temperature;	85%

: 67-56-1
methanol

: 16312-21-3
3-methyl-thiazolidine-2,4-dione

: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
at 25℃; Rate constant; different sodium methoxide concentration;

: 122801-33-6
C18H18NO5S(1-)

A: 96746-56-4
(E)-β-Methoxy-α-nitrostilbene

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
In water; dimethyl sulfoxide at 20℃; Equilibrium constant; Rate constant; ionic strength 0.5 M KCl;

: [(6-Hydroxy-2,2-dimethyl-4-oxo-4H-[1,3]dioxin-5-yl)-methoxy-phenyl-methylsulfanyl]-acetic acid methyl ester

A: 2365-48-2
Methyl thioglycolate

B: 212068-02-5
methoxybenzylidene Meldrum's acid

Conditions

Conditions	Yield
In water; dimethyl sulfoxide at 20℃; Rate constant; Equilibrium constant;

: 7-[(1R,2R)-2-((E)-(S)-3-Hydroxy-oct-1-enyl)-3-methoxycarbonylmethylsulfanyl-5-oxo-cyclopentyl]-heptanoic acid methyl ester

A: 16887-11-9
prostaglandin A1 methyl ester

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With deuterio phosphate buffer In d(4)-methanol at 25℃; pH=7.4; Equilibrium constant; Elimination;

: 7-[(2R,3R)-2-((E)-(S)-3-Hydroxy-oct-1-enyl)-3-methoxycarbonylmethylsulfanyl-5-oxo-cyclopent-(E)-ylidene]-heptanoic acid methyl ester

A: 2365-48-2
Methyl thioglycolate

B: 92711-55-2
Δ7-prostaglandin A1 methyl ester

Conditions

Conditions	Yield
With deuterio phosphate buffer In d(4)-methanol at 25℃; pH=7.4; Equilibrium constant; Elimination;

: C16H17O6S(1-)

A: 1214-54-6
5-benzylidene Meldrum's acid

B: 2365-48-2
Methyl thioglycolate

C: [(2,2-dimethyl-4,6-dioxo-[1,3]dioxan-5-yl)-phenyl-methylsulfanyl]-acetic acid methyl ester

Conditions

Conditions	Yield
With hydrogenchloride In water; dimethyl sulfoxide at 20℃; Kinetics; Further Variations:; pH-values; Elimination; protonation;

...Expand

: 771490-16-5
3-(4-hydroxy-phenyl)-2-(2-mercapto-acetylamino)-N-methyl-propionamide

SuccN-EELRRRLEELRRRRGG-SCH2C(O)-OMe: SuccN-EELRRRLEELRRRRGG-SCH2C(O)-OMe

A SuccN-EELRRRLEELRRRRGG-SCH2C(O)-YNHMe: SuccN-EELRRRLEELRRRRGG-SCH2C(O)-YNHMe

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
In phosphate buffer for 3h; pH=7.0; Equilibrium constant;

...Expand

: 771490-16-5
3-(4-hydroxy-phenyl)-2-(2-mercapto-acetylamino)-N-methyl-propionamide

methyl H-Asn-Gly20-mercaptoacetate: methyl H-Asn-Gly20-mercaptoacetate

A H-Asn-Gly20-mercaptoacetyl-Tyr-NHMe: H-Asn-Gly20-mercaptoacetyl-Tyr-NHMe

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With tris-(2-carboxyethyl)-phosphine hydrochloride pH=7; Equilibrium constant; aq. phosphate buffer;

...Expand

: 67-56-1
methanol

: 68-11-1
mercaptoacetic acid

: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With sulfuric acid for 4h; Reflux;	95%
With sulfuric acid for 4h; Reflux;	94%
at 40℃; for 3h; Temperature;	88.74%

: 84495-75-0
(N-Phenyl-formimidoylsulfanyl)-acetic acid methyl ester

A: 68-11-1
mercaptoacetic acid

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With hydrogenchloride In water Ambient temperature;	A 3% B 93%

: 1665-64-1
methyl bis(thioacetate)

: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With magnesium In methanol for 2h; Ambient temperature;	85%

: 67-56-1
methanol

: 16312-21-3
3-methyl-thiazolidine-2,4-dione

: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
at 25℃; Rate constant; different sodium methoxide concentration;

: 122801-33-6
C18H18NO5S(1-)

A: 96746-56-4
(E)-β-Methoxy-α-nitrostilbene

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
In water; dimethyl sulfoxide at 20℃; Equilibrium constant; Rate constant; ionic strength 0.5 M KCl;

: [(6-Hydroxy-2,2-dimethyl-4-oxo-4H-[1,3]dioxin-5-yl)-methoxy-phenyl-methylsulfanyl]-acetic acid methyl ester

A: 2365-48-2
Methyl thioglycolate

B: 212068-02-5
methoxybenzylidene Meldrum's acid

Conditions

Conditions	Yield
In water; dimethyl sulfoxide at 20℃; Rate constant; Equilibrium constant;

: 7-[(1R,2R)-2-((E)-(S)-3-Hydroxy-oct-1-enyl)-3-methoxycarbonylmethylsulfanyl-5-oxo-cyclopentyl]-heptanoic acid methyl ester

A: 16887-11-9
prostaglandin A1 methyl ester

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With deuterio phosphate buffer In d(4)-methanol at 25℃; pH=7.4; Equilibrium constant; Elimination;

: 7-[(2R,3R)-2-((E)-(S)-3-Hydroxy-oct-1-enyl)-3-methoxycarbonylmethylsulfanyl-5-oxo-cyclopent-(E)-ylidene]-heptanoic acid methyl ester

A: 2365-48-2
Methyl thioglycolate

B: 92711-55-2
Δ7-prostaglandin A1 methyl ester

Conditions

Conditions	Yield
With deuterio phosphate buffer In d(4)-methanol at 25℃; pH=7.4; Equilibrium constant; Elimination;

: C16H17O6S(1-)

A: 1214-54-6
5-benzylidene Meldrum's acid

B: 2365-48-2
Methyl thioglycolate

C: [(2,2-dimethyl-4,6-dioxo-[1,3]dioxan-5-yl)-phenyl-methylsulfanyl]-acetic acid methyl ester

Conditions

Conditions	Yield
With hydrogenchloride In water; dimethyl sulfoxide at 20℃; Kinetics; Further Variations:; pH-values; Elimination; protonation;

...Expand

: 771490-16-5
3-(4-hydroxy-phenyl)-2-(2-mercapto-acetylamino)-N-methyl-propionamide

SuccN-EELRRRLEELRRRRGG-SCH2C(O)-OMe: SuccN-EELRRRLEELRRRRGG-SCH2C(O)-OMe

A SuccN-EELRRRLEELRRRRGG-SCH2C(O)-YNHMe: SuccN-EELRRRLEELRRRRGG-SCH2C(O)-YNHMe

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
In phosphate buffer for 3h; pH=7.0; Equilibrium constant;

...Expand

: 771490-16-5
3-(4-hydroxy-phenyl)-2-(2-mercapto-acetylamino)-N-methyl-propionamide

methyl H-Asn-Gly20-mercaptoacetate: methyl H-Asn-Gly20-mercaptoacetate

A H-Asn-Gly20-mercaptoacetyl-Tyr-NHMe: H-Asn-Gly20-mercaptoacetyl-Tyr-NHMe

B: 2365-48-2
Methyl thioglycolate

Conditions

Conditions	Yield
With tris-(2-carboxyethyl)-phosphine hydrochloride pH=7; Equilibrium constant; aq. phosphate buffer;

...Expand

: C85H26O10S5

A: 1665-64-1
methyl bis(thioacetate)

B: 2365-48-2
Methyl thioglycolate

C: 741268-81-5, 741268-84-8, 133227-82-4, 133320-10-2, 133320-11-3, 133869-47-3, 134054-62-9, 134932-61-9, 149820-05-3, 149820-06-4, 157903-26-9, 175779-21-2, 115383-22-7, 958017-68-0, 958017-71-5, 958017-74-8, 958017-77-1, 958017-80-6, 140630-87-1, 140694-21-9, 151716-50-6, 157008-89-4, 220062-79-3, 220062-83-9
[5,6]fullerene-C70

Conditions

Conditions	Yield
at 50℃; Temperature;

...Expand

: 2365-48-2
Methyl thioglycolate

: 292638-85-8
acrylic acid methyl ester

: 7400-45-5
dimethyl-3-thiaadipate

Conditions

Conditions	Yield
With piperidine at 20℃; for 1h;	100%
With piperidine at 20℃;	100%
With piperidine at 50℃; for 2h;	99%

: 2365-48-2
Methyl thioglycolate

: 758-08-7
Thioglycolamide

Conditions

Conditions	Yield
With ammonia In methanol at 20℃; for 14h; Inert atmosphere;	100%
With ammonia In methanol at 23℃; for 48h; Inert atmosphere; Sealed tube;	99%
With ammonia

: 2365-48-2
Methyl thioglycolate

: 56146-83-9
chlorosulfonyl-acetic acid methyl ester

Conditions

Conditions	Yield
With chlorine In dichloromethane; water at -20 - -6℃;	100%
With water; chlorine In dichloromethane at 0℃;	92%
With chlorine In dichloromethane at 0 - 5℃;	83%

: 20688-29-3
dimethyl 2-bromofumarate

: 2365-48-2
Methyl thioglycolate

: 5556-24-1
dimethyl 3-hydroxythiophene-2,5-dicarboxylate

Conditions

Conditions	Yield
With sodium methylate In methanol Ambient temperature;	100%

: 2365-48-2
Methyl thioglycolate

: 112-89-0
1-Bromooctadecane

: 130614-27-6
methyl 2-(octadecylthio)acetate

Conditions

Conditions	Yield
With potassium carbonate In dimethyl sulfoxide; acetone at 20℃; for 48h;	100%
With potassium carbonate In dimethyl sulfoxide; acetone at 20℃; for 24h; Alkylation;	90%

: 2365-48-2
Methyl thioglycolate

: 402483-42-5
C28H25IO7

: 402483-43-6
C31H30O9S

Conditions

Conditions	Yield
With CsCO3 In N,N-dimethyl-formamide	100%

: 145219-22-3
2-nitroisophthalic acid diallyl ester

: 2365-48-2
Methyl thioglycolate

: 892128-04-0
3-hydroxybenzo[b]thiophene-2,7-dicarboxylic acid 7-allyl ester 2-methyl ester

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene In N,N-dimethyl-formamide for 1h;	100%
With 1,8-diazabicyclo[5.4.0]undec-7-ene In N,N-dimethyl-formamide at -78℃; for 1h;	100%

: 881034-04-4
3-methanesulfonyloxybenzo[b]thiophene-2,7-dicarboxylic acid 7-allyl ester 2-methyl ester

: 2365-48-2
Methyl thioglycolate

: 881034-05-5
3-hydroxythieno[3,2-b][1]benzothiophene-2,5-dicarboxylic acid 5-allyl ester 2-methyl ester

Conditions

Conditions	Yield
Stage #1: 3-methanesulfonyloxybenzo[b]thiophene-2,7-dicarboxylic acid 7-allyl ester 2-methyl ester; Methyl thioglycolate With triethylamine In N,N-dimethyl-formamide at 20℃; for 16h; Stage #2: With sodium hydride In N,N-dimethyl-formamide for 0.5h;	100%

: 2365-48-2
Methyl thioglycolate

: 3958-60-9
2-nitrophenylmethyl bromide

: 110035-67-1
(2-nitro-benzylsulfanyl)-acetic acid methyl ester

Conditions

Conditions	Yield
With potassium carbonate; potassium iodide In acetone for 4h; Heating / reflux;	100%
With sodium hydride In tetrahydrofuran at 20℃; for 2h;	99%

: 871476-79-8
2-bromo-1-(2-chloro-4-methylphenyl)ethanone

: 2365-48-2
Methyl thioglycolate

: 871476-80-1
methyl 2-(2-(2-chloro-4-methylphenyl)-2-oxoethylthio)acetate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 20℃; for 1h;	100%
With triethylamine In dichloromethane at 20℃; for 1h;	99%
With triethylamine In dichloromethane at 20℃; for 1h;

: 886049-63-4
5-bromo-1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-1H-benzimidazole

: 2365-48-2
Methyl thioglycolate

: 886049-65-6
methyl {[1-(cyclopropylmethyl)-2-(2,2-dimethyl-propyl)-1H-benzoimidazol-5-yl]thio}acetate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine; tris-(dibenzylideneacetone)dipalladium(0); 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane for 21h; Heating / reflux;	100%
With N-ethyl-N,N-diisopropylamine; tris-(dibenzylideneacetone)dipalladium(0); 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane for 24h; Heating / reflux;	100%
With N-ethyl-N,N-diisopropylamine; tris-(dibenzylideneacetone)dipalladium(0); 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane at 115℃; for 92h; Inert atmosphere;	93%

: lithium hydroxide monohydrate

: 2365-48-2
Methyl thioglycolate

: 623-70-1
ethyl (E)-crotonate

: 80289-37-8
4-ethoxycarbonyl-2-methylthiolan-3-one

Conditions

Conditions	Yield
In ethyl acetate; N,N-dimethyl-formamide	100%

...Expand

: 2768-02-7
(vinyl)trimethoxylsilane

: 2365-48-2
Methyl thioglycolate

: 70615-97-3
methyl S-[2-(trimethoxysilyl)ethyl]thioglycolate

Conditions

Conditions	Yield
at 20℃; for 3h; UV-irradiation; regioselective reaction;	100%

: ethyl 4,6-dichloropyrimidine-5-carboxylate

: 2365-48-2
Methyl thioglycolate

: ethyl 4-chloro-6-((2-methoxy-2-oxoethyl)thio)pyrimidine-5-carboxylate

Conditions

Conditions	Yield
With potassium carbonate In acetonitrile at 20℃; for 2h;	100%

: 1105665-42-6
5-bromo-2,3-difluorobenzonitrile

: 2365-48-2
Methyl thioglycolate

: methyl 3-amino-5-bromo-7-fluorobenzo[b]thiophene-2-carboxylate

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 0℃; for 1h;	100%

: 2365-48-2
Methyl thioglycolate

: 109-55-7
1-amino-3-(dimethylamino)propane

: C7H16N2OS

Conditions

Conditions	Yield
at 80 - 90℃;	100%

: 2365-48-2
Methyl thioglycolate

: 77-76-9
2,2-dimethoxy-propane

: 61713-28-8
dimethyl 2,2-(propane-2,2-diylbis(sulfanediyl))diacetate

Conditions

Conditions	Yield
With bismuth(III) chloride In acetonitrile at 50℃; for 72h; Inert atmosphere;	100%

: 2365-48-2
Methyl thioglycolate

: 176843-27-9
2,6-di-t-butyl-4-<(octylthio)methyliden>cyclohexa-2,5-dien-1-one

: 176843-24-6
2,6-di-t-butyl-4-<<(methoxycarbonyl)methylthio>(octylthio)methyl>phenol

Conditions

Conditions	Yield
With triethylamine In hexane at 65℃; for 2h;	99.8%

: 50-00-0
formaldehyd

: 114136-76-4
2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]aniline

: 2365-48-2
Methyl thioglycolate

: C16H14ClF4N3O4S

Conditions

Conditions	Yield
In water; toluene for 2h; Reflux;	99.2%
In toluene at 20 - 110℃;	92%

...Expand

: 2365-48-2
Methyl thioglycolate

: 1665-64-1
methyl bis(thioacetate)

Conditions

Conditions	Yield
With TiO2/MoS2 (10:1 molar ratio of Ti to Mo) nanocomposite; air In ethanol at 20℃; for 8h; Irradiation; Green chemistry;	99%
With copper(II) hydroxide phosphate In tetrahydrofuran; water at 20℃; for 2h; Catalytic behavior; Solvent; Irradiation;	98%
With ammonium cerium(IV) nitrate In acetonitrile for 0.333333h;	91%

: 80-63-7
methyl 2-chloroacrylate

: 2365-48-2
Methyl thioglycolate

: 90237-73-3
α-Chlor-β-<(methoxycarbonylmethyl)thio>propansaeure-methylester

Conditions

Conditions	Yield
With sodium In dichloromethane at 25℃; for 0.666667h;	99%

: 5147-80-8
[Bis(methylthio)methylene]malononitrile

: 2365-48-2
Methyl thioglycolate

: 129332-45-2
methyl 3-amino-4-cyano-5-(methylsulfanyl)-2-thiophenecarboxylate

Conditions

Conditions	Yield
With triethylamine In methanol for 2h; Reflux;	99%
With triethylamine In methanol for 1h; Heating;	84%
With triethylamine In methanol at 130℃; for 0.0666667h; Microwave irradiation;	82%
With triethylamine In methanol

: 102-96-5
(2-nitroethenyl)benzene

: 2365-48-2
Methyl thioglycolate

: 76665-83-3, 91134-32-6
methyl {[alpha-(nitromethyl)benzyl]thio}acetate

Conditions

Conditions	Yield
With C37H56N4O4; lanthanum(lll) triflate In 1,2-dichloro-ethane at 0℃; for 1h; Sulfa-Michael addition;	99%
With triethylamine In tetrahydrofuran at 20℃; for 2h; Michael addition;	97%
In benzene Heating;

: 112-29-8
1-bromo dodecane

: 2365-48-2
Methyl thioglycolate

: 294201-51-7
methyl 2-(decylthio)acetate

Conditions

Conditions	Yield
With potassium carbonate In dimethyl sulfoxide; acetone at 20℃; for 24h; Alkylation;	99%
With potassium carbonate In dimethyl sulfoxide; acetone at 20℃; for 48h;	86%

: 98-88-4
benzoyl chloride

: 2365-48-2
Methyl thioglycolate

: 6398-72-7
S-methoxycarbonylmethyl benzothioate

Conditions

Conditions	Yield
Stage #1: benzoyl chloride; Methyl thioglycolate In dichloromethane at 20℃; Stage #2: With poly{trans-bicyclo[2.2.1]hept-5-ene-2,3-di(chlorocarbonyl)} In dichloromethane Heating;	99%

: 886049-81-6
5-bromo-2-(2,2-dimethylpropyl)-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazole

: 2365-48-2
Methyl thioglycolate

: 886049-82-7
methyl {[2-(2,2-dimethylpropyl)-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]thio}acetate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine; tris-(dibenzylideneacetone)dipalladium(0); 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane at 120℃; for 0.5h; Microwaves;	99%

: 2365-48-2
Methyl thioglycolate

: 79-10-7
acrylic acid

: 93274-67-0
3-(2-methoxy-2-oxoethylsulfanyl)-propanoic acid

Conditions

Conditions	Yield
With tetrabutyl ammonium fluoride at 50℃; for 1h;	99%

: Ge[(CH2)6Ge[(CH2)6Ge((CH2)4CHCH2)3]3]4

: 2365-48-2
Methyl thioglycolate

: Ge[(CH2)6Ge[(CH2)6Ge((CH2)6SCH2CO2CH3)3]3]4

Conditions

Conditions	Yield
In neat (no solvent) excess thioglycolate; chromy. (SiO2);	99%

: 865434-80-6
6-(methanesulfonyloxymethyl)-9-(2-deoxy-3,5-di-O-(p-toluoyl)-β-D-erythro-pentofuranosyl)purine

: 2365-48-2
Methyl thioglycolate

: 1025504-52-2
6-[(methoxycarbonylmethyl)sulfanylmethyl]-9-(2-deoxy-3,5-di-O-p-toluoyl-β-D-erythro-pentofuranosyl)purine

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In acetonitrile for 10h;	99%

: 865434-79-3
6-(methanesulfonyloxymethyl)-9-(2,3,5-tri-O-(p-toluoyl)-β-D-ribofuranosyl)purine

: 2365-48-2
Methyl thioglycolate

: 1025504-50-0
6-[(methoxycarbonylmethyl)sulfanylmethyl]-9-(2,3,5-tri-O-p-toluoyl-β-D-ribofuranosyl)purine

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In acetonitrile for 8h;	99%

Methyl thioglycolate Consensus Reports

Reported in EPA TSCA Inventory.

Methyl thioglycolate Specification

With the cas registry number 2365-48-2, methylmercaptoacetate is a kind of clear colourless liquid. Its IUPAC name is methyl 2-sulfanylacetate and the systematic name is methyl sulfanylacetate. This chemical is sensitive to air and is insoluble in water while soluble in carbinol, alcohol and benzene and other organic solvent. As to its usage, it is the raw material of phytocide Thifensulfuron Methyl and it could be often used as the pharmaceutic intermediate.

The physical properties of this chemical are as follows: (1)(1)ACD/LogP: 0.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.65; (4)ACD/LogD (pH 7.4): 0.59; (5)ACD/BCF (pH 5.5): 1.84; (6)ACD/BCF (pH 7.4): 1.6; (7)ACD/KOC (pH 5.5): 53.8; (8)ACD/KOC (pH 7.4): 46.86; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 51.6; (13)Index of Refraction: 1.448; (14)Molar Refractivity: 25.61 cm³; (15)Molar Volume: 95.5 cm³; (16)Polarizability: 10.15 ×10^-24cm³; (17)Surface Tension: 32.4 dyne/cm; (18)Density: 1.11 g/cm³; (19)Flash Point: 35 °C; (20)Enthalpy of Vaporization: 38.88 kJ/mol; (21)Boiling Point: 151.9 °C at 760 mmHg; (22)Vapour Pressure: 3.58 mmHg at 25°C; (23)Exact Mass: 106.00885; (24)MonoIsotopic Mass: 106.00885; (25)Topological Polar Surface Area: 27.3; (26)Heavy Atom Count: 6; (27)Formal Charge: 0; (28)Complexity: 52.8.

Use of this chemical: methylmercaptoacetate could react with formaldehyde to produce chloromethylsulfanyl-acetic acid methyl ester, with the following condition: reagent: hydrogen chloride; reaction temp.: 0 °C.

When you are dealing with this kind of chemical, you should be much more careful and then take some measures to protect yourself. For one thing, it is harmful which may cause damage to health. And it is irritating to eyes, respiratory system and skin. If by inhalation or swallowed, it will be very dangerous. For another thing, it is toxic which may at low levels cause damage to health. Therefore, you should firstly wear suitable protective clothing, gloves and eye/face protection. And then take some instructions while meeting with the following conditions. If in case of contact with eyes, rinse immediately with plenty of water and seek medical advice; If in case of accident or if you feel unwell, seek medical advice immediately (show label where possible); After contacting with skin, wash immediately with plenty of ... (to be specified by the manufacturer).

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: COC(=O)CS
(2)InChI: InChI=1S/C3H6O2S/c1-5-3(4)2-6/h6H,2H2,1H3
(3)InChIKey: MKIJJIMOAABWGF-UHFFFAOYSA-N

Below are the toxicity information of this chemical:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	100mg/kg (100mg/kg)		National Technical Information Service. Vol. AD277-689,
rat	LD50	intraperitoneal	252mg/kg (252mg/kg)		Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
rat	LD50	oral	84mg/kg (84mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: TREMOR SKIN AND APPENDAGES (SKIN): HAIR: OTHER	National Technical Information Service. Vol. OTS0570921

Product Name

Methyl thioglycolate

Synthetic route

Methyl thioglycolate Consensus Reports

Methyl thioglycolate Specification

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