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4-tert-Butylbenzoic acid

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About This Item

Linear Formula:
(CH3)3CC6H4CO2H
CAS Number:
98-73-7
Molecular Weight:
178.23
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24849021
EC Number:
202-696-3
Beilstein/REAXYS Number:
607545
MDL number:
MFCD00002563
Assay:
99%
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Quality Segment

assay

99%

mp

162-165 °C (lit.)

functional group

carboxylic acid

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 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.

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Pictograms

Health hazardExclamation mark
GHS08,GHS07

Signal Word

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

WGK 3

PPE (personal protective equipment)

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

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