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Merck
CN

239755

4-叔丁基苯甲酸

≥99%

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线性分子式:
(CH3)3CC6H4CO2H
化学文摘社编号:
分子量:
178.23
EC Number:
202-696-3
UNSPSC Code:
12352100
MDL number:
Beilstein/REAXYS Number:
607545
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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

General description

4-tert-Butylbenzoic acid is an endocrine-disrupting chemical (EDC) present in honey. It was quantitated by an analytical method based on liquid chromatography-electrospray ionisation mass spectrometry (LC-ESI-MS).


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E Rodríguez-Gonzalo et al.
Analytical and bioanalytical chemistry, 398(3), 1239-1247 (2010-03-26)
The present work describes the development and validation of an analytical method based on liquid chromatography (LC), coupled with tandem mass spectrometry (MS/MS) that allows the determination and confirmation of several endocrine-disrupting chemicals (EDCs) in honey. The EDCs studied were
I Anundi et al.
Chemico-biological interactions, 50(3), 277-288 (1984-08-01)
Isolated hepatocytes incubated with selenite (30-100 microM) exhibited changes in the glutathione redox system as shown by an increase in O2 consumption, oxidation of glutathione and loss of NADPH. Selenite (50 microM) raised O2 consumption within the 1 h and
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)