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Key Documents

35376

Supelco

Cuelure

PESTANAL®, analytical standard

Synonym(s):

4-(3-Oxobutyl)phenyl acetate, Cue-lure, Q-lure, 4-(4-Acetoxyphenyl)-2-butanone

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About This Item

Linear Formula:
CH3CO2C6H4CH2CH2COCH3
CAS Number:
Molecular Weight:
206.24
Beilstein/REAXYS Number:
1961620
EC Number:
MDL number:
UNSPSC Code:
41116107
PubChem Substance ID:
NACRES:
NA.24

grade

analytical standard

product line

PESTANAL®

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.509 (lit.)

bp

123-124 °C/0.2 mmHg (lit.)

density

1.099 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care

format

neat

SMILES string

CC(=O)CCc1ccc(OC(C)=O)cc1

InChI

1S/C12H14O3/c1-9(13)3-4-11-5-7-12(8-6-11)15-10(2)14/h5-8H,3-4H2,1-2H3

InChI key

UMIKWXDGXDJQJK-UHFFFAOYSA-N

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Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Recommended products

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

Legal Information

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

Storage Class

10 - Combustible liquids

wgk_germany

WGK 2

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup


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Questions

  1. Is it safe for human?

    1 answer
    1. This is a research grade product not suitable for animal or human consumption. This product is used as an analytical standard for the analysis of food and cosmetics.

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