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D153303

Sigma-Aldrich

5,5-Dimethyl-1,3-cyclohexanedione

95%

Sinónimos:

Dimedone, Methone

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About This Item

Fórmula lineal:
(CH3)2C6H6(=O)2
Número de CAS:
126-81-8
Peso molecular:
140.18
Beilstein/REAXYS Number:
471489
EC Number:
204-804-4
MDL number:
MFCD00001588
UNSPSC Code:
12352100
PubChem Substance ID:
24893475
NACRES:
NA.22

assay

95%

form

powder

mp

146-148 °C (lit.)

SMILES string

CC1(C)CC(=O)CC(=O)C1

InChI

1S/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H3

InChI key

BADXJIPKFRBFOT-UHFFFAOYSA-N

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Categorías relacionadas

Application

Part of furannulation strategy for the synthesis of naturally occurring fused 3-methylfurans.

Storage Class

11 - Combustible Solids

wgk_germany

WGK 2

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Certificados de análisis (COA)

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Sigma-Aldrich

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Sulfenic acids, formed as transient intermediates during the reaction of cysteine residues with peroxides, play significant roles in enzyme catalysis and regulation, and are also involved in the redox regulation of transcription factors and other signaling proteins. Therefore, interest in
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Symmetrical and non-symmetrical diimines derived from dimedone were synthesized by the reaction of their corresponding enaminothiones with primary amines. The synthesized compounds were characterized using micro analytical data and NMR spectroscopy. Theoretical calculations by B3LYP/6-31G(d,p) level of theory show that
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