150355

4-tert-Butylbenzoic acid

99%

• 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%

Properties

• Quality Segment: 100
• 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

Description

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.

Safety Information

• Pictograms: GHS08,GHS07
• Signal Word: Danger
• Hazard Codes: H302,H360F,H372,H412
• Precautionary Statements: P202 - P260 - P264 - P273 - P301 + P312 - P308 + P313
• 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