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2-(Methylthio)-1H-indole-3-carbaldehyde

CAS No.
113866-44-7
Chemical Name:
2-(Methylthio)-1H-indole-3-carbaldehyde
Synonyms
Brassicanal A;2-Methylthio-1H-indole-3-carbaldehyde;2-(Methylthio)-1H-indole-3-carbaldehyde;1H-Indole-3-carboxaldehyde, 2-(methylthio)-
CBNumber:
CB62442998
Molecular Formula:
C10H9NOS
Molecular Weight:
191.25
MDL Number:
MOL File:
113866-44-7.mol
Last updated:2023-07-01 08:28:08

2-(Methylthio)-1H-indole-3-carbaldehyde Properties

Melting point 233-234 °C
Boiling point 393.0±27.0 °C(Predicted)
Density 1.29±0.1 g/cm3(Predicted)
pka 15.23±0.30(Predicted)

2-(Methylthio)-1H-indole-3-carbaldehyde Chemical Properties,Uses,Production

Definition

ChEBI: Brassicanal A is a member of indoles.

Metabolic pathway

Three main biotransformation products are identified by fungal cultures of the blackleg fungus with brassicanal A. The final transformation product from brassicanal A is via oxidation of the sulfur atom of the methylmercapto group and then hydrogenation of the formyl group to a methyl group to give 3-methylindole- 2-methylsulfoxide which undergoes no further metabolism to afford transformed products.

67282-55-7
5188-07-8
113866-44-7
Synthesis of 2-(Methylthio)-1H-indole-3-carbaldehyde from 1-METHOXYINDOLE-3-CARBOXALDEHYDE and Sodium thiomethoxide

2-(Methylthio)-1H-indole-3-carbaldehyde Preparation Products And Raw materials

Raw materials

Preparation Products

2-(Methylthio)-1H-indole-3-carbaldehyde 2-Methylthio-1H-indole-3-carbaldehyde Brassicanal A 1H-Indole-3-carboxaldehyde, 2-(methylthio)- 113866-44-7