142174

Sigma-Aldrich

6-Ethoxy-2-mercaptobenzothiazole

99%

Synonym(s):
6-Ethoxy-2-benzothiazolethiol
Empirical Formula (Hill Notation):
C9H9NOS2
CAS Number:
Molecular Weight:
211.30
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22
Pricing and availability is not currently available.

Quality Level

assay

99%

mp

198-200 °C (lit.)

SMILES string

CCOc1ccc2nc(S)sc2c1

InChI

1S/C9H9NOS2/c1-2-11-6-3-4-7-8(5-6)13-9(12)10-7/h3-5H,2H2,1H3,(H,10,12)

InChI key

HOASVNMVYBSLSU-UHFFFAOYSA-N

General description

6-Ethoxy-2-mercaptobenzothiazole is a potential matrix for matrix-assisted laser desorption mass spectrometry for accurate mass determination of biomolecules.

Packaging

5 g in glass bottle

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Target Organs

Respiratory system

RIDADR

NONH for all modes of transport

WGK Germany

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Mercaptobenzothiazoles: A new class of matrices for laser desorption ionization mass spectrometry.
Xu N, et al.
Journal of the American Society For Mass Spectrometry, 8(2), 116-124 (1997)
Fen Pei et al.
Scientific reports, 7(1), 17803-17803 (2017-12-21)
Quantitative Systems Pharmacology (QSP) is a drug discovery approach that integrates computational and experimental methods in an iterative way to gain a comprehensive, unbiased understanding of disease processes to inform effective therapeutic strategies. We report the implementation of QSP to...

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