2-Ethylhexyl mercaptoacetate supplier

Name
2-Ethylhexyl mercaptoacetate
EINECS 231-626-4
CAS No. 7659-86-1
Density 0.972 g/cm³
Solubility 4.73mg/L at 20℃
Melting Point -31oC
Formula C₁₀H₂₀O₂S
Boiling Point 270.9 °C at 760 mmHg
Molecular Weight 204.334
Flash Point 137.4 °C
Transport Information UN 3272 3/PG 3
Appearance Clear liquid
Safety 26-36/37
Risk Codes 10-20/22-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms Aceticacid, mercapto-, 2-ethylhexyl ester (6CI,7CI,8CI,9CI);2-Ethylhexyl2-mercaptoacetate;2-Ethylhexyl thioglycolate;Mercaptoacetic acid 2-ethylhexyl ester;
PSA 65.10000
LogP 2.67580

Synthetic route

: 92-84-2
10H-phenothiazine

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: N-(2-Ethylhexyloxycarbonylmethylthiomethyl)-phenothiazine

Conditions

Conditions	Yield
With paraformaldehyde	99%

: 92-84-2
10H-phenothiazine

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: N-(2-Ethylhexyloxycarbonylmethylthiomethyl)-phenothiazine

Conditions

Conditions	Yield
With paraformaldehyde	99%

: 3091-25-6
n-octyltin trichloride

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 27107-89-7
octyltin tris(isooctyl thioglycollate)

Conditions

Conditions	Yield
With sodium hydroxide In water at 50℃; for 2h; Product distribution / selectivity;	98%

: 3091-25-6
n-octyltin trichloride

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

octyltin tris(isooctyl thioglycollate): 27107-89-7
octyltin tris(isooctyl thioglycollate)

Conditions

Conditions	Yield
With sodium hydroxide In water at 50℃; for 2h; Product distribution / selectivity;	98%

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-Ethylhexyl N,N-diphenylaminomethylthioacetate: 2-Ethylhexyl N,N-diphenylaminomethylthioacetate

Conditions

Conditions	Yield
With diphenylamine; paraformaldehyde In water; toluene	97.6%

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-Ethylhexyl N,N-diphenylaminomethylthioacetate

Conditions

Conditions	Yield
With diphenylamine; paraformaldehyde In water; toluene	97.6%

: 90-30-2
N-phenyl-1-naphthylamine

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-Ethylhexyl N-phenyl-N-naphthylaminomethylthioacetate: 2-Ethylhexyl N-phenyl-N-naphthylaminomethylthioacetate

Conditions

Conditions	Yield
With paraformaldehyde	96.8%

: 90-30-2
N-phenyl-1-naphthylamine

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-Ethylhexyl N-phenyl-N-naphthylaminomethylthioacetate

Conditions

Conditions	Yield
With paraformaldehyde	96.8%

: 626-55-1
3-Bromopyridine

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: C15H23NO2S

Conditions

Conditions	Yield
With tris-(dibenzylideneacetone)dipalladium(0); N-ethyl-N,N-diisopropylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane at 100℃; for 2h;	96.26%

: 626-55-1
3-Bromopyridine

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: C15H23NO2S

Conditions

Conditions	Yield
With tris-(dibenzylideneacetone)dipalladium(0); N-ethyl-N,N-diisopropylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In 1,4-dioxane at 100℃; for 2h;	96.26%

: 67-56-1
methanol

: 10175-01-6
bis(2-methoxycarbonylethyl)tin dichloride

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

di(2-methoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate): 66491-79-0
di(2-methoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate)

Conditions

Conditions	Yield
With sodium hydrogencarbonate In methanol byproducts: NaCl; addn. of alcohol to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	95%

...Expand

: 67-56-1
methanol

: 10175-01-6
bis(2-methoxycarbonylethyl)tin dichloride

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 66491-79-0
di(2-methoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate)

Conditions

Conditions	Yield
With sodium hydrogencarbonate In methanol byproducts: NaCl; addn. of alcohol to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	95%

...Expand

: 50-00-0
formaldehyd

: 128-39-2
2,6-di-tert-butylphenol

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-ethylhexyl 2-(3,5-di-tert-butyl-4-hydroxybenzylthio)acetate: 2-ethylhexyl 2-(3,5-di-tert-butyl-4-hydroxybenzylthio)acetate

Conditions

Conditions	Yield
With 2,6-di-tert-butyl-4-(dimethylaminomethyl)phenol In N,N-dimethyl-formamide at 120℃; for 4h;	92%

...Expand

: 50-00-0
formaldehyd

: 128-39-2
2,6-di-tert-butylphenol

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl 2-(3,5-di-tert-butyl-4-hydroxybenzylthio)acetate

Conditions

Conditions	Yield
With 2,6-di-tert-butyl-4-(dimethylaminomethyl)phenol In N,N-dimethyl-formamide at 120℃; for 4h;	92%

...Expand

: 64-17-5
ethanol

: 10175-02-7
Cl2Sn(CH2CH2COOC2H5)2

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

di(2-ethoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate): 86176-72-9
di(2-ethoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate)

Conditions

Conditions	Yield
With sodium hydrogencarbonate In ethanol byproducts: NaCl; addn. of alcohol to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	92%

...Expand

: 64-17-5
ethanol

Cl2Sn(CH2CH2COOC2H5)2: 10175-02-7
Cl2Sn(CH2CH2COOC2H5)2

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 86176-72-9
di(2-ethoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate)

Conditions

Conditions	Yield
With sodium hydrogencarbonate In ethanol byproducts: NaCl; addn. of alcohol to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	92%

...Expand

: 88261-93-2
(C6H5CH2OC(O)CH2CH2)2SnCl2

: 100-51-6
benzyl alcohol

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

(C6H5CH2OC(O)CH2CH2)2Sn(SCH2CO2CH2CH(C2H5)(CH2)3CH3)2: 88261-95-4
(C6H5CH2OC(O)CH2CH2)2Sn(SCH2CO2CH2CH(C2H5)(CH2)3CH3)2

Conditions

Conditions	Yield
With sodium hydrogencarbonate In further solvent(s) byproducts: NaCl; addn. of PhCH2OH to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	90%

...Expand

(C6H5CH2OC(O)CH2CH2)2SnCl2: 88261-93-2
(C6H5CH2OC(O)CH2CH2)2SnCl2

: 100-51-6
benzyl alcohol

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 88261-95-4
(C6H5CH2OC(O)CH2CH2)2Sn(SCH2CO2CH2CH(C2H5)(CH2)3CH3)2

Conditions

Conditions	Yield
With sodium hydrogencarbonate In further solvent(s) byproducts: NaCl; addn. of PhCH2OH to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	90%

...Expand

: 61470-33-5
Cl2Sn(CH2CH2COOCH2CH2CH2CH3)2

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 71-36-3
butan-1-ol

di(2-butoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate): 84332-98-9
di(2-butoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate)

Conditions

Conditions	Yield
With sodium hydrogencarbonate In further solvent(s) byproducts: NaCl; addn. of n-butanol to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	90%

...Expand

Cl2Sn(CH2CH2COOCH2CH2CH2CH3)2: 61470-33-5
Cl2Sn(CH2CH2COOCH2CH2CH2CH3)2

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 71-36-3
butan-1-ol

: 84332-98-9
di(2-butoxycarbonylethyl)tin S,S'-bis-(2-ethylhexyl thioglycolate)

Conditions

Conditions	Yield
With sodium hydrogencarbonate In further solvent(s) byproducts: NaCl; addn. of n-butanol to mixt. of Sn compd. and HSCH2COOC8H17-i, 50-60°C, slow addn. of NaHCO3, 2-3h, NaCl removed by washing with water; mass spectroscopy;	90%

...Expand

: di(2-ethylhexyl) 3,7-bis(trifluoromethanesulfonyloxy)benzo[1,2-b:4,5-b']dithiophene-2,6-dicarboxylate

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

bis(2-ethylhexyl) 3,7-bis((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)benzo[1,2-b:4,5-b']dithiophene-2,6-dicarboxylate: bis(2-ethylhexyl) 3,7-bis((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)benzo[1,2-b:4,5-b']dithiophene-2,6-dicarboxylate

Conditions

Conditions	Yield
With potassium phosphate In N,N-dimethyl-formamide at 20℃; for 18h; Inert atmosphere;	70%

di(2-ethylhexyl) 3,7-bis(trifluoromethanesulfonyloxy)benzo[1,2-b:4,5-b']dithiophene-2,6-dicarboxylate: di(2-ethylhexyl) 3,7-bis(trifluoromethanesulfonyloxy)benzo[1,2-b:4,5-b']dithiophene-2,6-dicarboxylate

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: bis(2-ethylhexyl) 3,7-bis((2-((2-ethylhexyl)oxy)-2-oxoethyl)thio)benzo[1,2-b:4,5-b']dithiophene-2,6-dicarboxylate

Conditions

Conditions	Yield
With potassium phosphate In N,N-dimethyl-formamide at 20℃; for 18h; Inert atmosphere;	70%

: 103-44-6
2-ethylhexyl vinyl ether

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-ethylhexyl 2-(2-(2-ethylhexyloxy)ethylthio)acetate: 2-ethylhexyl 2-(2-(2-ethylhexyloxy)ethylthio)acetate

Conditions

Conditions	Yield
With 2,2'-azobis(isobutyronitrile) at 115℃; for 24h; Sealed tube;	68%

2-ethylhexyl vinyl ether: 103-44-6
2-ethylhexyl vinyl ether

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl 2-(2-(2-ethylhexyloxy)ethylthio)acetate

Conditions

Conditions	Yield
With 2,2'-azobis(isobutyronitrile) at 115℃; for 24h; Sealed tube;	68%

: (+/-)-(E)-1-((1RS,2SR)-2,6,6-trimethylcyclohex-3-enyl)but-2-en-1-one

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-ethylhexyl (±)-({4-oxo-4-[(1RS,2SR)-2,6,6-trimethylcyclohex-3-en-1-yl]butan-2-yl}sulfanyl)acetate: 2-ethylhexyl (±)-({4-oxo-4-[(1RS,2SR)-2,6,6-trimethylcyclohex-3-en-1-yl]butan-2-yl}sulfanyl)acetate

Conditions

Conditions	Yield
In dimethyl sulfoxide at 20℃; for 72h; Michael Addition;	62%

: (+/-)-(E)-1-((1RS,2SR)-2,6,6-trimethylcyclohex-3-enyl)but-2-en-1-one

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl (±)-({4-oxo-4-[(1RS,2SR)-2,6,6-trimethylcyclohex-3-en-1-yl]butan-2-yl}sulfanyl)acetate

Conditions

Conditions	Yield
In dimethyl sulfoxide at 20℃; for 72h; Michael Addition;	62%

: 874-05-5
3-aminoindazole

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-ethylhexyl 3-aminobenzo[b]thiophene-2-carboxylate: 2-ethylhexyl 3-aminobenzo[b]thiophene-2-carboxylate

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; copper diacetate; sodium hydroxide In water; acetonitrile at 80℃; for 22h; Sealed tube; Inert atmosphere;	62%

: 874-05-5
3-aminoindazole

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl 3-aminobenzo[b]thiophene-2-carboxylate

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; copper diacetate; sodium hydroxide In water; acetonitrile at 80℃; for 22h; Sealed tube; Inert atmosphere;	62%

: 18791-78-1
4-bromothiophene-3-carboxaldehyde

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

2-ethylhexyl thieno[3,4-b]thiophene-2-carboxylate: 2-ethylhexyl thieno[3,4-b]thiophene-2-carboxylate

Conditions

Conditions	Yield
With copper(II) oxide; potassium carbonate In dimethyl sulfoxide at 60℃; for 16h; Inert atmosphere;	56%
With potassium carbonate; copper(II) oxide In N,N-dimethyl-formamide

4-bromothiophene-3-carboxaldehyde: 18791-78-1
4-bromothiophene-3-carboxaldehyde

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl thieno[3,4-b]thiophene-2-carboxylate

Conditions

Conditions	Yield
With copper(II) oxide; potassium carbonate In dimethyl sulfoxide at 60℃; for 16h; Inert atmosphere;	56%
With potassium carbonate; copper(II) oxide In N,N-dimethyl-formamide

: 1338214-56-4
4-chloro-3-(methoxalyl)coumarin

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 1338214-87-1
2-(2-ethylhexyl) 3-methyl 4-oxo-4H-thieno[3,2-c]chromene-2,3-dicarboxylate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 0 - 20℃; Inert atmosphere; regioselective reaction;	54%

: 1264667-66-4
4-chloro-3-(trifluoroacetyl)-2H-1-benzopyran-2-one

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 1338214-86-0
2-ethylhexyl 4-oxo-3-(trifluoromethyl)-4H-thieno[3,2-c]chromene-2-carboxylate

Conditions

Conditions	Yield
Stage #1: 4-chloro-3-(trifluoroacetyl)-2H-1-benzopyran-2-one; mercaptoacetic acid 2-ethylhexyl ester With triethylamine In N,N-dimethyl-formamide at 20℃; for 16h; Inert atmosphere; Stage #2: With chloro-trimethyl-silane In N,N-dimethyl-formamide at 100℃; for 6h; Inert atmosphere; regioselective reaction;	47%

: 15707-31-0
2,3‐dichloro-5,6‐dimethyl‐1,4‐benzoquinone

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

A: 2-ethylhexyl 2-(2-chloro-4,5-dimethyl-3,6-dioxocyclohexa-1,4-dienylthio)acetate

B: bis(2-ethylhexyl)2,2’-(4,5-dimethyl-3,6-dioxocyclohexa-1,4-diene-1,2-diyl) bis(sulfanediyl) diacetate

Conditions

Conditions	Yield
In ethanol at 20℃;	A 38% B 8%

...Expand

: 6-bromo-2-isooctyl-2H-benzo[d][1,2,3]triazole-5-carbaldehyde

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-(2-ethylhexyl)-2H-benzo[d][1,2,3]triazolo[2,3-f]thiophene-6-carboxylic acid 2-ethylhexyl ester

Conditions

Conditions	Yield
With potassium carbonate In dimethyl sulfoxide at 80℃; for 2h; Microwave irradiation;	36.2%

: 58613-36-8
dibutyl 2,5-dibromoterephthalate

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 74-88-4
methyl iodide

: C14H10O6S2

Conditions

Conditions	Yield
Stage #1: dibutyl 2,5-dibromoterephthalate; mercaptoacetic acid 2-ethylhexyl ester With 1,1'-bis-(diphenylphosphino)ferrocene; tris-(dibenzylideneacetone)dipalladium(0); N-ethyl-N,N-diisopropylamine at 100℃; for 15h; Stage #2: With potassium tert-butylate In N,N-dimethyl-formamide at 100℃; for 3h; Stage #3: methyl iodide Further stages;	31%

...Expand

: C16H20Br2O4

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 74-88-4
methyl iodide

: C14H10O6S2

Conditions

Conditions	Yield
Stage #1: C16H20Br2O4; mercaptoacetic acid 2-ethylhexyl ester With 1,1'-bis-(diphenylphosphino)ferrocene; tris-(dibenzylideneacetone)dipalladium(0); N-ethyl-N,N-diisopropylamine at 100℃; for 15h; Stage #2: With potassium tert-butylate In N,N-dimethyl-formamide at 100℃; for 3h; Stage #3: methyl iodide Further stages;	21%

...Expand

: 22286-99-3
(E)-2-octen-4-one

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: (±)-2-ethylhexyl 2-((4-oxooctan-2-yl)thio)acetate

Conditions

Conditions	Yield
at 20℃; for 576h;	7%

: 5813-57-0
2-acetyl-1,4-naphthoquinone

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: (3-acetyl-1,4-dihydroxy-naphthalen-2-ylsulfanyl)-acetic acid 2-ethyl-hexyl ester

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; for 0.25h;

: 1125-55-9
2-Acetyl-1,4-benzoquinone

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: (2-acetyl-3,6-dihydroxy-phenylsulfanyl)-acetic acid 2-ethyl-hexyl ester

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; for 0.25h;

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl 3-methyl-4,7-dioxo-4,7-dihydrobenzo[b]thiophene-2-carboxylate

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: tetrahydrofuran / 0.25 h / 20 °C 2: 3 h / 80 °C 3: aq. HCl / acetonitrile / 0.08 h 4: CAN / acetonitrile; H2O / 0.5 h View Scheme

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 4,7-dihydroxy-3-methyl-benzo[b]thiophene-2-carboxylic acid 2-ethyl-hexyl ester

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: tetrahydrofuran / 0.25 h / 20 °C 2: 3 h / 80 °C 3: aq. HCl / acetonitrile / 0.08 h View Scheme

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 2-ethylhexyl 3-methyl-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-2-carboxylate

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: tetrahydrofuran / 0.25 h / 20 °C 2: 3 h / 80 °C 3: aq. HCl / diethyl ether 4: air; silica gel / hexane; ethyl acetate View Scheme

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 4,9-dihydroxy-3-methyl-naphtho[2,3-b]thiophene-2-carboxylic acid 2-ethyl-hexyl ester

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: tetrahydrofuran / 0.25 h / 20 °C 2: 3 h / 80 °C 3: aq. HCl / diethyl ether View Scheme

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 3-methyl-4,7-bis-trimethylsilanyloxy-benzo[b]thiophene-2-carboxylic acid 2-ethyl-hexyl ester

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: tetrahydrofuran / 0.25 h / 20 °C 2: 3 h / 80 °C View Scheme

: 7659-86-1
mercaptoacetic acid 2-ethylhexyl ester

: 3-methyl-4,9-bis-trimethylsilanyloxy-naphtho[2,3-b]thiophene-2-carboxylic acid 2-ethyl-hexyl ester

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: tetrahydrofuran / 0.25 h / 20 °C 2: 3 h / 80 °C View Scheme

2-Ethylhexyl mercaptoacetate Specification

The 2-Ethylhexyl mercaptoacetate, with the CAS registry number 7659-86-1, is also known as Thioglykolsaeure-2-aethylhexyl ester. It belongs to the product category of Industrial/Fine Chemicals. Its EINECS registry number is 231-626-4. This chemical's molecular formula is C₁₀H₂₀O₂S and molecular weight is 204.33. Its IUPAC name is called 2-ethylhexyl 2-sulfanylacetate. This chemical can be used as a stabilizer in the plastic products, especially PVC products..

Physical properties of 2-Ethylhexyl mercaptoacetate: (1)ACD/LogP: 4.19; (2)ACD/LogD (pH 5.5): 4.19; (3)ACD/LogD (pH 7.4): 4.12; (4)ACD/BCF (pH 5.5): 894.21; (5)ACD/BCF (pH 7.4): 769.59; (6)ACD/KOC (pH 5.5): 4508.04; (7)ACD/KOC (pH 7.4): 3879.74; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 9; (10)Index of Refraction: 1.46; (11)Molar Refractivity: 58 cm³; (12)Molar Volume: 211.5 cm³; (13)Surface Tension: 32.2 dyne/cm; (14)Density: 0.966 g/cm³; (15)Flash Point: 137.4 °C; (16)Enthalpy of Vaporization: 50.91 kJ/mol; (17)Boiling Point: 270.9 °C at 760 mmHg; (18)Vapour Pressure: 0.00666 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful by inhalation and if swallowed. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCC(CC)COC(=O)CS
(2)InChI: InChI=1S/C10H20O2S/c1-3-5-6-9(4-2)7-12-10(11)8-13/h9,13H,3-8H2,1-2H3
(3)InChIKey: OWHSTLLOZWTNTQ-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
guinea pig	LD50	oral	955mg/kg (955mg/kg)	Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
mouse	LD50	intraperitoneal	865mg/kg (865mg/kg)	Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
mouse	LD50	oral	1430mg/kg (1430mg/kg)	Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
rabbit	LD50	oral	534mg/kg (534mg/kg)	Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
rat	LD50	intraperitoneal	265mg/kg (265mg/kg)	Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.
rat	LD50	oral	303mg/kg (303mg/kg)	Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 575, 1974.

Product Name

2-Ethylhexyl mercaptoacetate

Synthetic route

2-Ethylhexyl mercaptoacetate Specification

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