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Merck

W200910

Acetophenone

greener alternative

natural, 98%, FG

Synonym(s):

Methyl phenyl ketone

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About This Item

Linear Formula:
CH3COC6H5
CAS Number:
98-86-2
Molecular Weight:
120.15
Flavis number:
7.004
PubChem Substance ID:
329830436
UNSPSC Code:
12164502
FEMA Number:
2009
NACRES:
NA.21
EC Number:
202-708-7
MDL number:
MFCD00008724
Beilstein/REAXYS Number:
605842
Organoleptic:
almond; cherry; coumarin; nutty; sweet; vanilla
Grade:
FG, Fragrance grade, Kosher, natural
Biological source:
cassia oil
Agency:
follows IFRA guidelines
Food allergen:
no known allergens

Key Documents

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InChI key

KWOLFJPFCHCOCG-UHFFFAOYSA-N

InChI

1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3

SMILES string

CC(=O)c1ccccc1

biological source

cassia oil

grade

FG, Fragrance grade, Kosher, natural

agency

follows IFRA guidelines

reg. compliance

EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002, FDA 21 CFR 117

vapor density

4.1 (vs air)

vapor pressure

0.45 mmHg ( 25 °C), 1 mmHg ( 15 °C)

assay

98%

form

liquid, semisolid

autoignition temp.

1058 °F

greener alternative product characteristics

Less Hazardous Chemical Syntheses
Use of Renewable Feedstocks
Learn more about the Principles of Green Chemistry.

sustainability

Greener Alternative Product

Quality Level

300

bp

202 °C (lit.)

mp

19-20 °C (lit.)

density

1.03 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

greener alternative category

Aligned,

organoleptic

almond; cherry; coumarin; nutty; sweet; vanilla

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General description

We are committed to bringing you Greener Alternative Products, which adhere to one of the four categories of Greener Alternatives . This product is a Biobased products, showing key improvements in Green Chemistry Principles “Less Hazardous Chemical Syntheses” and “Use of Renewable Feedstock”.

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H302,H319

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2

Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

179.6 °F - closed cup

flash_point_c

82 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
SHBP1605
SHBP0753
SHBN6015
SHBN3858
SHBL3580

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Ruben De Pauw et al.
Journal of chromatography. A, 1420, 129-134 (2015-10-20)
A new system is proposed for applying fast temperature gradients in liquid chromatography. It consists of a 0.7 mm × 150 mm fused-silica column coated with a 50 μm Nickel-layer, which is connecting with a power source and a temperature
Gabriela Antunes et al.
PloS one, 9(8), e105531-e105531 (2014-08-22)
Olfactory adaptation is a fundamental process for the functioning of the olfactory system, but the underlying mechanisms regulating its occurrence in intact olfactory sensory neurons (OSNs) are not fully understood. In this work, we have combined stochastic computational modeling and
Fabrice Gritti et al.
Journal of chromatography. A, 1384, 76-87 (2015-02-11)
Previous data have shown that could deliver a minimum reduced plate height as small as 1.7. Additionally, the reduction of the mesopore size after C18 derivatization and the subsequent restriction for sample diffusivity across the Titan-C18 particles were found responsible
Fabrice Gritti et al.
Journal of chromatography. A, 1355, 164-178 (2014-06-28)
In a previous report, it was reported that columns packed with fully porous 1.9μm Titan-C18 particles provided a minimum reduced plate height as small as 1.7 for the most retained compound (n-octanophenone) under RPLC conditions. These particles are characterized by
Fabrice Gritti et al.
Journal of chromatography. A, 1355, 179-192 (2014-07-09)
The mass transfer mechanism in four prototype columns (2.1 and 3.0×50mm, 2.1 and 3.0×100mm) packed with 1.9μm fully porous Titan-C18 particles was investigated by using two previously reported home-made protocols. The first one was used to measure the eddy dispersion
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