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158828

Sigma-Aldrich

2-Mercapto-4(3H)-quinazolinone

97%

Empirical Formula (Hill Notation):
C8H6N2OS
CAS Number:
Molecular Weight:
178.21
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22

assay

97%

form

liquid

mp

>300 °C (lit.)

SMILES string

SC1=Nc2ccccc2C(=O)N1

InChI

1S/C8H6N2OS/c11-7-5-3-1-2-4-6(5)9-8(12)10-7/h1-4H,(H2,9,10,11,12)

InChI key

PUPFOFVEHDNUJU-UHFFFAOYSA-N

General description

The FTIR and FT-Raman spectra of 2-mercapto-4(3H) quinazolinone has been studied. Alkylation of 2-mercapto-4(3H)-quinazolinone has been reported.

Application

2-Mercapto-4(3H)-quinazolinone was employed as a modifier for the carbon paste electrode, for voltammetric determination of mercury. It was used in the synthesis of 4-quinazolinone derivatives, inhibitors of the DNA repair enzyme poly(ADP-ribose) polymerase.

Packaging

10 g in poly bottle

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificate of Analysis

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Certificate of Origin

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