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T33006

Sigma-Aldrich

(Phenylthio)acetic acid

96%

Synonym(s):

(Phenylmercapto)acetic acid, S-Phenylthioglycolic acid, Thiophenoxyacetic acid

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About This Item

Linear Formula:
C6H5SCH2COOH
CAS Number:
Molecular Weight:
168.21
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

96%

mp

60-63 °C (lit.)

SMILES string

OC(=O)CSc1ccccc1

InChI

1S/C8H8O2S/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)

Inchi Key

MOTOSAGBNXXRRE-UHFFFAOYSA-N

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Pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


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Patrick Masson et al.
Biochimica et biophysica acta, 1774(1), 16-34 (2006-12-22)
Catalytic parameters of human butyrylcholinesterase (BuChE) for hydrolysis of homologous pairs of oxo-esters and thio-esters were compared. Substrates were positively charged (benzoylcholine versus benzoylthiocholine) and neutral (phenylacetate versus phenylthioacetate). In addition to wild-type BuChE, enzymes containing mutations were used. Single
Rui Zhang et al.
Bioorganic & medicinal chemistry letters, 17(14), 3855-3859 (2007-05-26)
A novel series of potent and selective PPARdelta agonists, para-alkylthiophenoxyacetic acids, was identified. The synthesis and structure-activity relationships are described.
R E Saari et al.
Biochemistry, 37(9), 3035-3042 (1998-04-16)
The first step in catabolism of the broadleaf herbicide 2,4-dichlorophenoxyacetic acid (2,4-D) is catalyzed by 2,4-D/alpha-ketoglutarate (alpha-KG)-dioxygenase (TfdA) in Ralstonia eutropha (formerly Alcaligenes eutrophus) JMP134. This oxygen- and ferrous-ion-dependent enzyme couples the oxidative decarboxylation of alpha-KG (yielding CO2 and succinate)
Rui Zhang et al.
Bioorganic & medicinal chemistry letters, 19(4), 1101-1104 (2009-01-27)
Synthesis and SAR of para-alkylthiophenoxyacetic acids is described. Achiral compounds 30, 31 and 32 were identified as potent and selective PPARdelta agonists.
L Rodrigo et al.
Chemico-biological interactions, 119-120, 263-275 (1999-07-27)
The existence of two or more enzyme forms with paraoxonase activity has been reported in sheep, rabbit, human and rat serum and recently in mouse and rat liver. In this study we describe the presence of two peaks with paraoxonase

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