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117021

2-Methyl-1,3-cyclopentanedione

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About This Item

Linear Formula:
CH3C5H5(=O)2
CAS Number:
765-69-5
Molecular Weight:
112.13
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24847313
EC Number:
212-153-2
Beilstein/REAXYS Number:
1237255
MDL number:
MFCD00001406
Assay:
99%
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Quality Segment

100

assay

99%

mp

212-215 °C (lit.)

functional group

ketone

SMILES string

CC1C(=O)CCC1=O

InChI

1S/C6H8O2/c1-4-5(7)2-3-6(4)8/h4H,2-3H2,1H3

InChI key

HXZILEQYFQYQCE-UHFFFAOYSA-N

Gene Information

human ... ACHE(43), BCHE(590), CES1(1066)

Application

2-Methyl-1,3-cyclopentanedione hs been used to explore deoxycholic acid (DCA) induced changes in cell signaling. DCA is a secondary bile acid implicated in numerous pathological conditions. It has also been used in the synthesis of (-)-curcumanolide A and (-)-curcumalactone by aldol-lactonization.

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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