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223034

Sigma-Aldrich

1-Phenyl-1,2-propanedione

99%

Synonym(s):

Acetyl benzoyl

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About This Item

Linear Formula:
C6H5COCOCH3
CAS Number:
Molecular Weight:
148.16
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

99%

form

liquid

impurities

1% methyl benzoate

refractive index

n20/D 1.532 (lit.)

bp

103-105 °C/14 mmHg (lit.)

density

1.101 g/mL at 25 °C (lit.)

SMILES string

CC(=O)C(=O)c1ccccc1

InChI

1S/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H3

InChI key

BVQVLAIMHVDZEL-UHFFFAOYSA-N

Gene Information

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General description

The enantioselective hydrogenation of 1-phenyl-1,2-propanedione over Pt colloids was studied.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

183.2 °F - closed cup

Flash Point(C)

84 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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William Cunha Brandt et al.
Journal of dentistry, 39(6), 438-447 (2011-04-23)
The aim of this study was to evaluate the degree of conversion (DC), rate of polymerization (R(p)(max)), Knoop hardness (KHN) and bond strength between tooth/restoration of composite resins containing different photo-initiators photo-activated by different light-curing units (LCUs). A mixture of
Luis Felipe J Schneider et al.
Dental materials : official publication of the Academy of Dental Materials, 25(3), 369-375 (2008-10-14)
To evaluate the effect of amine ratio (ethyl 4-dimethylaminobenzoate, EDMAB) on the maximum rate of polymerization (R(p)(max)), degree of conversion (DC), Knoop hardness (KH), water sorption (Wsp), water solubility (Wsl) and color changes (DeltaE) over time of resin composites formulated
Marcello G Trevisan et al.
Talanta, 75(4), 1021-1027 (2008-07-01)
Fourier transform mid-infrared spectroscopy (FT-MIR) coupled with a homemade attenuated total reflectance (ATR) flow-cell was used for on-line monitoring of a biotransformation reaction. The reaction was also monitored off-line by gas chromatography-mass spectrometry (GC-MS) enabling to establish a multivariate model
Hiroyuki Arikawa et al.
Dental materials journal, 28(4), 454-460 (2009-09-02)
The purpose of this study was to investigate effects of various visible light photoinitiators on the polymerization efficiency and color of the light-activated resins. Four photoinitiators, including camphorquinone, phenylpropanedione, monoacrylphosphine oxide (TPO), and bisacrylphosphine oxide (Ir819), were used. Each photoinitiator
Susy Lopes et al.
The journal of physical chemistry. A, 109(25), 5560-5570 (2006-07-13)
1-Phenyl-1,2-propanedione has been isolated in low-temperature xenon matrixes and studied by FTIR spectroscopy, supported by DFT(B3LYP)/6-311++G(d,p) calculations. In good agreement with previous electron diffraction data [Shen, Q.; Hagen, K. J. Phys. Chem. 1993, 97, 985], the calculations predicted the existence

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