CAS No.7659-86-1,2-Ethylhexyl mercaptoacetate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	7659-86-1
Name:	2-Ethylhexyl mercaptoacetate

Formula:	C₁₀H₂₀O₂S
Molecular Weight:	204.334
Synonyms:	Aceticacid, mercapto-, 2-ethylhexyl ester (6CI,7CI,8CI,9CI);2-Ethylhexyl2-mercaptoacetate;2-Ethylhexyl thioglycolate;Mercaptoacetic acid 2-ethylhexyl ester;
EINECS:	231-626-4
Density:	0.972 g/cm³
Melting Point:	-31oC
Boiling Point:	270.9 °C at 760 mmHg
Flash Point:	137.4 °C
Solubility:	4.73mg/L at 20℃
Appearance:	Clear liquid
Hazard Symbols:	Xn
Risk Codes:	10-20/22-36/37/38
Safety:	26-36/37
Transport Information:	UN 3272 3/PG 3
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%

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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.