T33006
(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
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
203-073-9
MDL number:
Assay:
96%
InChI key
MOTOSAGBNXXRRE-UHFFFAOYSA-N
InChI
1S/C8H8O2S/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)
SMILES string
OC(=O)CSc1ccccc1
assay
96%
mp
60-63 °C (lit.)
Quality Level
Related Categories
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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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, 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.
A Q Zhang et al.
Chemosphere, 36(15), 3033-3041 (1998-09-25)
Batch data of aerobic microbial degradation rate constants Kb of phenylthio, phenylsulfinyl and phenylsulfonyl acetates have been determined, and the qualitative relationships between their Kb and chemical structures were analyzed. The phenylthio acetates were most subject to microbial transformation, followed
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
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.
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