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655147

Sigma-Aldrich

2,4,6-Trichloroanisole-d5

98 atom % D

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About This Item

Linear Formula:
Cl3C6D2OCD3
CAS Number:
352439-08-8
Molecular Weight:
216.50
MDL number:
MFCD01074305
UNSPSC Code:
41116107
PubChem Substance ID:
329760069
NACRES:
NA.12

isotopic purity

98 atom % D

Quality Level

200

bp

132 °C/28 mmHg (lit.)

mp

60-62 °C (lit.)

format

neat

mass shift

M+5

SMILES string

[2H]c1c(Cl)c([2H])c(Cl)c(OC([2H])([2H])[2H])c1Cl

InChI

1S/C7H5Cl3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3/i1D3,2D,3D

InChI key

WCVOGSZTONGSQY-RHIBPKLGSA-N

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Application

This product may be used as an analytical standard.

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302,H319,H413

Precautionary Statements

P305 + P351 + P338

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Chronic 4 - Eye Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MBBC8380
MBBC1943
ST0042

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Navideh Sadoughi et al.
Journal of agricultural and food chemistry, 63(11), 2877-2885 (2015-02-24)
An optimized method for the quantitation of volatile compounds responsible for off-aromas, such as earthy odors, found in wine and grapes was developed. The method involved a fast and simple headspace solid-phase microextraction-gas chromatography-mass spectrometry (HS-SPME-GC-MS) for simultaneous determination of

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