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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Acetic acid, (ethylthio)-

CCSCC(=O)O Request for Quotation
Chemical Name: Acetic acid, (ethylthio)-
CAS Number: 627-04-3
Product Number: AG003AYH(AGN-PC-0JL8ZO)
Synonyms:
MDL No:
Molecular Formula: C4H8O2S
Molecular Weight: 120.1701

Identification/Properties

Properties
MP:
-8.5℃
Storage:
2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
120.166g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
120.025g/mol
Monoisotopic Mass:
120.025g/mol
Topological Polar Surface Area:
62.6A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
62.7
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Danger
UN#:
3265
Hazard Statements:
H227-H314
Precautionary Statements:
P264-P271-P280-P301+P330+P331-P304+P340-P305+P351+P338-P310-P363-P370+P378-P403+P233-P501
Class:
8
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


(Ethylthio)acetic acid, also known as ethylthioacetic acid, is a versatile compound widely used in chemical synthesis. This compound is valued for its ability to serve as a key building block in the production of various organic molecules.Its application in chemical synthesis is mainly attributed to its unique structure, which includes a thioether functional group. This thioether moiety enables (Ethylthio)acetic acid to participate in a variety of important reactions, such as nucleophilic substitution, oxidation, and reduction reactions. Additionally, the ethyl group attached to the sulfur atom enhances the compound's reactivity and solubility in organic solvents.In organic synthesis, (Ethylthio)acetic acid can be used as a thioester synthon for the preparation of thioesters, which are valuable intermediates in the synthesis of peptides, esters, and other sulfur-containing compounds. It can also serve as a precursor for the generation of α-thioacetic acids, which find application in the synthesis of pharmaceuticals, agrochemicals, and materials chemistry.Furthermore, (Ethylthio)acetic acid can participate in various multicomponent reactions, enabling the construction of complex molecular frameworks efficiently. Its compatibility with a wide range of functional groups makes it a versatile tool for the synthesis of diverse organic compounds with potential applications in drug discovery, materials science, and biotechnology.