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Key Documents

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150355

Sigma-Aldrich

4-tert-Butylbenzoic acid

99%

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About This Item

Fórmula lineal:
(CH3)3CC6H4CO2H
Número de CAS:
98-73-7
Peso molecular:
178.23
Beilstein/REAXYS Number:
607545
EC Number:
202-696-3
MDL number:
MFCD00002563
UNSPSC Code:
12352100
PubChem Substance ID:
24849021
NACRES:
NA.22

Quality Level

100

assay

99%

mp

162-165 °C (lit.)

SMILES string

CC(C)(C)c1ccc(cc1)C(O)=O

InChI

1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)

InChI key

KDVYCTOWXSLNNI-UHFFFAOYSA-N

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General description

4-tert-Butylbenzoic acid was determined in water samples by means of liquid chromatography-electrospray ionisation mass spectrometry (LC-ESI-MS).

Application

4-tert-Butylbenzoic acid was used as a potent yeast sirtuin (Sir2p) inhibitor.

pictograms

Health hazardExclamation mark
GHS08,GHS07

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Chronic 3 - Repr. 1B - STOT RE 1

Storage Class

6.1D - Non-combustible acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects

wgk_germany

WGK 3

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

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Patrycja Makoś et al.
Journal of chromatography. A, 1517, 26-34 (2017-09-01)
The paper presents a new method for the determination of 15 carboxylic acids in samples of postoxidative effluents from the production of petroleum bitumens using ion-pair dispersive liquid-liquid microextraction and gas chromatography coupled to mass spectrometry with injection port derivatization.
Yi-Pei Chen et al.
Bioorganic & medicinal chemistry letters, 24(1), 349-352 (2013-11-26)
Employing a genetically modified yeast strain as a screening tool, 4-dimethylaminobenzoic acid (5) was isolated from the marine sediment-derived Streptomyces sp. CP27-53 as a weak yeast sirtuin (Sir2p) inhibitor. Using this compound as a scaffold, a series of disubstituted benzene
Inhibition of hepatic gluconeogenesis and lipogenesis by benzoic acid, p-tert.-butylbenzoic acid, and a structurally related hypolipidemic agent SC-33459.
S A McCune et al.
Archives of biochemistry and biophysics, 214(1), 124-133 (1982-03-01)
Adeline Martin et al.
Carbohydrate polymers, 93(2), 718-730 (2013-03-19)
The aim of this work was to develop the formation of multilayered coating incorporating a cyclodextrin polyelectrolyte onto a non-woven polyethylene terephthalate (PET) textile support in order to obtain reservoir and sustained release properties towards bioactive molecules. We optimized the
M D Whorton et al.
Scandinavian journal of work, environment & health, 7(3), 204-213 (1981-09-01)
The possible testicular effects resulting from occupational exposure to para-tertiary butyl benzoic acid (p-TBBA) were studied in 90 male volunteers employed at the Martinez, California, facility of the Shell Chemical Company. The comparison data used were obtained from an external
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