D153303
5,5-Dimethyl-1,3-cyclohexanedione
95%
Synonym(s):
Dimedone, Methone
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About This Item
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Quality Level
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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Application
Part of furannulation strategy for the synthesis of naturally occurring fused 3-methylfurans.
Storage Class Code
11 - Combustible Solids
WGK
WGK 2
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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The Journal of Organic Chemistry, 58, 3960-3960 (1993)
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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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