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W322601

1-Phenyl-1,2-propanedione

98%, FG

Synonym(s):

Acetyl benzoyl

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About This Item

Linear Formula:
C6H5COCOCH3
CAS Number:
579-07-7
Molecular Weight:
148.16
FEMA Number:
3226
Council of Europe no.:
2275
UNSPSC Code:
12164502
PubChem Substance ID:
24901567
Flavis number:
7.079
EC Number:
209-435-2
NACRES:
NA.21
MDL number:
MFCD00008755
Organoleptic:
honey; buttery; plastic
Grade:
FG, Halal, Kosher
Biological source:
synthetic
Agency:
meets purity specifications of JECFA
Food allergen:
no known allergens

Key Documents

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biological source

synthetic

Quality Level

300, 400

grade

FG, Halal, Kosher

agency

meets purity specifications of JECFA

reg. compliance

EU Regulation 1334/2008 & 178/2002

assay

98%

refractive index

n20/D 1.532 (lit.)

bp

103-105 °C/14 mmHg (lit.)

density

1.101 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

honey; buttery; plastic

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

human ... CES1(1066)

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Related Categories

General description

1-Phenyl-1,2-propanedione is a volatile flavor compound found in khat leaves and cambará honey.

Application


  • A Simplified Kinetic Model for the Enantioselective Hydrogenation of 1-Phenyl-1,2-Propanedione over Ir/TiO(2) in the Presence of a Chiral Additive.: This study presents a simplified kinetic model for the enantioselective hydrogenation of 1-Phenyl-1,2-propanedione, emphasizing its potential in synthetic organic chemistry and catalysis, which could have significant implications for pharmaceutical synthesis and industrial applications (Melián-Cabrera et al., 2022).

  • Moving Towards a Finer Way of Light-Cured Resin-Based Restorative Dental Materials: Recent Advances in Photoinitiating Systems Based on Iodonium Salts.: Although primarily focused on photoinitiating systems for dental materials, this review could indirectly encompass applications of 1-Phenyl-1,2-propanedione in dental photopolymerization processes, suggesting potential for further exploration in dental material enhancements (Topa and Ortyl, 2020).

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

183.2 °F - closed cup

flash_point_c

84 °C - closed cup

ppe

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

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Certificates of Analysis (COA)

Lot/Batch Number
SHBT2392
SHBR3088
SHBR0275
SHBP8974
STBJ4178

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Naturally occurring norephedrine oxazolidine derivatives in khat (Catha edulis).
Krizevski R, et al.
Planta Medica, 78(08), 838-842 (2012)
Investigation of the aroma compounds from headspace and aqueous solution from the cambara (Gochnatia Velutina) honey
Moreira RFA & De Maria CAB.
Flavour and Fragrance Journal, 20(1), 13-17 (2005)
Luis Felipe J Schneider et al.
Dental materials : official publication of the Academy of Dental Materials, 25(5), 566-572 (2008-12-30)
Stress development during the polymerization process continues to be a major factor that limits predictability and longevity of resin composite restorations. This study evaluated the effect of the photoinitiator type on the maximum rate of polymerization (R(p)(max)), stress development (final
Igor Busygin et al.
The Journal of organic chemistry, 73(17), 6559-6569 (2008-08-08)
Structures and conformational behavior of several cinchona alkaloid O-ethers in the solid state (X-ray), in solution (NMR and DFT), and in the gas phase (DFT) were investigated. In the crystal, O-phenylcinchonidine adopts the Open(3) conformation similar to cinchonidine, whereas the
Luis Felipe J Schneider et al.
Dental materials : official publication of the Academy of Dental Materials, 24(9), 1169-1177 (2008-03-08)
To evaluate the degree of conversion (DC), maximum rate of polymerization (Rpmax), Knoop hardness (KHN) and yellowing (b-value) of resin composites formulated with phenylpropanedione (PPD), camphorquinone (CQ), or CQ/PPD at different concentrations. The hypotheses tested were (i) PPD or CQ/PPD
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Global Trade Item Number

SKUGTIN
W322601-SAMPLE-K04061837528316
W322601-5KG-K04061837528309
W322601-1KG-K04061837807329
W322601-100G-K04061837807312

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