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Propan-2-yl 2-sulfanylacetate

CAT: 0804-HY-W200537-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W200537-01Size:25 mg
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Description
Propan-2-yl 2-sulfanylacetate (Isopropyl thioglycolate) can be used as a stabilizer for dyes, an additive for flame retardants, and a component in metal cleaning agents, etc[1].
CAS Number
7383-61-1
Product Name Alternative
Isopropyl thioglycolate
UNSPSC
12352100
Hazard Statement
H226-H315-H319-H335
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Smiles
O=C(OC(C)C)CS
Molecular Formula
C5H10O2S
Molecular Weight
134.20
Precautions
P210-P240-P241-P242-P243-P261-P264-P271-P280-P302+P352-P303+P361+P353-P304+P340-P305+P351+P338-P362-P370+P378-P403+P233-P403+P235-P405-P501
References & Citations
[1]Burnett CL, Bergfeld WF, Belsito DV, Klaassen CD, Marks JG Jr, Shank RC, Slaga TJ, Snyder PW; Cosmetic Ingredient Review Expert Panel; Andersen FA. Final amended report on the safety assessment of Ammonium Thioglycolate, Butyl Thioglycolate, Calcium Thioglycolate, Ethanolamine Thioglycolate, Ethyl Thioglycolate, Glyceryl Thioglycolate, Isooctyl Thioglycolate, Isopropyl Thioglycolate, Magnesium Thioglycolate, Methyl Thioglycolate, Potassium Thioglycolate, Sodium Thioglycolate, and Thioglycolic Acid. Int J Toxicol. 2009 Jul-Aug;28 (4 Suppl) :68-133.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Isopropyl Thioglycolate

Based on the available data, the CIR Expert Panel concluded that ... Isopropyl Thioglycolate is safe for use in hair straighteners, permanent waves, tonics, dressings, and so forth, wave sets, other non-coloring hair products, and hair dyes and colors, as described in this safety assessment, at concentrations up to 15.2% (as Thioglycolic Acid). Hairdressers should avoid skin contact and minimize consumer skin exposure.

CAS Number7383-61-1
PubChem CID81864
IUPAC Namepropan-2-yl 2-sulfanylacetate
Molecular FormulaC5H10O2S
Molecular Weight134.20
XLogP1.2
Topological Polar Surface Area27.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count8
Formal Charge0
Complexity80
SMILES
CC(C)OC(=O)CS
InChI
InChI=1S/C5H10O2S/c1-4(2)7-5(6)3-8/h4,8H,3H2,1-2H3
InChIKey
KLHDJBCAYIXOTA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Isopropyl Thioglycolate
CAS: 7383-61-1
CID: 81864
Formula: C5H10O2S
MW: 134.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight134.20
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass134.04015073
Monoisotopic Mass134.04015073
Topological Polar Surface Area27.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity80.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-B524470-100MGPropan-2-yl 2-Sulfanylacetate
UAA78848-012-Methoxyethyl 2-sulfanylacetate
JH265917Potassium,2-sulfanylacetate
HAA38363-01Benzyl 2-sulfanylacetate
RAA84998-01Cyclohexyl 2-sulfanylacetate
PCC76638-012-[2- (Propan-2-yl) phenyl]propan-2-amine
GEA98932-012-[2- (Propan-2-yl) phenyl]propan-2-ol
EEC94945-012- (Propan-2-yl) thiomorpholine
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