2-tert-Butyl-1,4-benzoquinone

CAS NO.：3602-55-9
Empirical Formula: C10H12O2
Molecular Weight: 164.2
MDL number: MFCD00666928
EINECS: 222-757-8
SAFETY DATA SHEET (SDS)
Update Date: 2024-11-19 23:02:33

What is 2-tert-Butyl-1,4-benzoquinone?

Chemical properties

Yellow crystalline powder

The Uses of 2-tert-Butyl-1,4-benzoquinone

2-tert-Butyl-1,4-benzoquinone may be used in the synthesis of azatrioxa[8]circulene.

General Description

2-tert-Butyl-1,4-benzoquinone (TBQ, TBBQ, tBQ, BuBQ, BQ , tert-butyl-p-quinone) is a 1,4-benzoquinone derivative. It is a major metabolite of the food additive, butylated hydroxyanisole (BHA). TBQ is reported to be strongly cytotoxic in human monocytic leukemia U937 cells. TBQ is an oxidation product of 2-tert-butylhydroquinone (TBHQ). Studies confirm that TBQ induces apoptosis and cell proliferation inhibition in chronic myelogenous leukemia (CML) cells. Its binding interactions with lysozyme has been examined and found to be intermediate between BHA and TBHQ. It has been reported to be synthesized by the titanium superoxide catalyzed oxidation of 2-tert-butylphenol using aq. 30% H₂O₂. TBQ is one of the main neoformed compounds from TBHQ decomposition in PLA-TBHQ film (Poly lactic acid).

Properties of 2-tert-Butyl-1,4-benzoquinone

Melting point:	54-58 °C(lit.)
Boiling point:	227.8±15.0 °C(Predicted)
Density	1.092±0.06 g/cm3(Predicted)
storage temp.	Sealed in dry,Room Temperature
solubility	Chloroform, Methanol (Slightly)
form	Solid
color	Dark Yellow
CAS DataBase Reference	3602-55-9(CAS DataBase Reference)
NIST Chemistry Reference	2,5-Cyclohexadiene-1,4-dione, 2-(1,1-dimethylethyl)-(3602-55-9)

Safety information for 2-tert-Butyl-1,4-benzoquinone

Signal word	Warning
Pictogram(s)	Exclamation Mark Irritant GHS07
GHS Hazard Statements	H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes	P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.