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10916

Sigma-Aldrich

Acetylacetone

produced by Wacker Chemie AG, Burghausen, Germany, ≥99.5% (GC)

Synonym(s):

AcAc, 2,4-Pentanedione

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About This Item

Linear Formula:
CH3COCH2COCH3
CAS Number:
123-54-6
Molecular Weight:
100.12
Beilstein/REAXYS Number:
741937
EC Number:
204-634-0
MDL number:
MFCD00008787
UNSPSC Code:
12352100
eCl@ss:
39021208
PubChem Substance ID:
57646851
NACRES:
NA.22

grade

produced by Wacker Chemie AG, Burghausen, Germany

vapor density

3.5 (vs air)

vapor pressure

6 mmHg ( 20 °C)

assay

≥99.5% (GC)

form

liquid

autoignition temp.

662 °F

expl. lim.

11.4 %

refractive index

n20/D 1.452 (lit.)

pH

6 (20 °C, 200 g/L)

bp

140.4 °C (lit.)

mp

−23 °C (lit.)

solubility

H2O: soluble 1 in 8 parts
acetone: miscible
alcohol: miscible
benzene: miscible
chloroform: miscible
diethyl ether: miscible
glacial acetic acid: miscible

density

0.975 g/mL at 25 °C (lit.)

SMILES string

CC(=O)CC(C)=O

InChI

1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3

InChI key

YRKCREAYFQTBPV-UHFFFAOYSA-N

Gene Information

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

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General description

Acetylacetone is a chelating ligand and forms organometallic complexes that are used as gasoline additives, lubricant additives, driers for varnishes and printer′s inks, fungicides, insecticides and colors. It is a selective extraction reagent for determination of molybdenum in ferrous materials.

Application

Acetylacetone was used in preparing Y203, La203 and La2CuO4 thin films and the titanate/anatase dual-phase photocatalyst.

Other Notes

prices for bulk quantities on request

pictograms

FlameSkull and crossbones
GHS02,GHS06

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk_germany

WGK 1

flash_point_f

95.0 °F - closed cup

flash_point_c

35 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Nitrogen- sensitized Dual Phase Titanate/Titania for Visible-light Driven Phenol Degradation.
Hua CY, et al.
Journal of Solid State Chemistry, 1962012, 518-527 null
Growth and characterization of thin films of Y203, La203 and La2CuO4.
Gao YM, et al.
Journal of Solid State Chemistry, 90(2), 228-233 (1991)
Analytical Solvent Extraction of Molybenum Using Acetylacetone.
McKaveney JP and Freiser H.
Analytical Chemistry, 29(2), 290-292 (1957)
Giuliano Alagona et al.
Physical chemistry chemical physics : PCCP, 12(35), 10173-10188 (2010-08-03)
The catalytic effect of explicit water molecules on the keto-enol tautomerism in a system of biological interest (enolpyruvate) has been investigated at the B3LYP/6-31++G** level by exploring the potential energy surface in the presence of 1 or 2 water molecules
Haymo Pircher et al.
The Journal of biological chemistry, 286(42), 36500-36508 (2011-09-01)
The human fumarylacetoacetate hydrolase (FAH) domain-containing protein 1 (FAHD1) is part of the FAH protein superfamily, but its enzymatic function is unknown. In the quest for a putative enzymatic function of FAHD1, we found that FAHD1 exhibits acylpyruvase activity, demonstrated
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