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Merck
CN

341258

4,4-Dimethyl-1,3-cyclohexanedione

98%

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About This Item

Linear Formula:
(CH3)2C6H6(=O)2
CAS Number:
Molecular Weight:
140.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
98%
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Quality Segment

assay

98%

bp

130 °C/7 mmHg (lit.)

mp

103-105 °C (lit.)

functional group

ketone

SMILES string

CC1(C)CCC(=O)CC1=O

InChI

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

InChI key

PLGPBTCNKJQJHQ-UHFFFAOYSA-N

General description

Standard molar enthalpy of formation of 4,4-dimethyl-1,3-cyclohexanedione in the gaseous state at 298.15K has been determined.

Application

4,4-Dimethyl-1,3-cyclohexanedione was employed in the synthesis of series of 4-aryl-6,6-dimethyl-1,2,3,4,5,6,7,8- octahydroquinazoline-2,5-diones via Biginelli reaction.


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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