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Merck
CN

36544

Chloroacetic acid

PESTANAL®, analytical standard

Synonym(s):

Monochloroacetic acid

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About This Item

Linear Formula:
ClCH2COOH
CAS Number:
Molecular Weight:
94.50
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
EC Number:
201-178-4
Beilstein/REAXYS Number:
605438
MDL number:
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Product Name

Chloroacetic acid, PESTANAL®, analytical standard

InChI key

FOCAUTSVDIKZOP-UHFFFAOYSA-N

InChI

1S/C2H3ClO2/c3-1-2(4)5/h1H2,(H,4,5)

SMILES string

OC(=O)CCl

grade

analytical standard

vapor density

3.26 (vs air)

vapor pressure

0.75 mmHg ( 20 °C)

product line

PESTANAL®

assay

98-100% (HPLC)

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

bp

189 °C (lit.)

mp

60-63 °C (lit.)

application(s)

agriculture
environmental

format

neat

Quality Level

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Application

Chloroacetic acid may be used as an analytical reference standard for the analysis of chloroacetic acid in:
  • Natural waters by ion chromatography-electrospray ionization-tandem mass spectrometry (IC-ESI-MS/MS).
  • Bottled water, swimming pool water, and both source water and drinking water from a drinking water facility by high performance IC-ESI-MS/MS with multiple reaction monitoring (MRM) detection.
  • Tap water by gas chromatography-mass spectrometry (GC-MS).
  • Drinking water by GC coupled to halogen-specific detector equipped with MS operating under the electron ionization mode.

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

Disclaimer

The product is not intended for use as a biocide under global biocide regulations, including but not limited to US EPA′s Federal Insecticide Fungicide and Rodenticide Act, European Biocidal Products Regulation, Canada’s Pest Management Regulatory Agency, Turkey’s Biocidal Products Regulation, Korea’s Consumer Chemical Products and Biocide Safety Management Act (K-BPR) and others.

General description

Chloroacetic acid belongs to the class of haloacetic acid compounds.
Chloroacetic acid is the degradation product of the herbicide, chloroacetanilide.

Legal Information

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

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Acute 1 - Eye Dam. 1 - Skin Corr. 1B - STOT SE 3

target_organs

Respiratory system

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 3

flash_point_f

258.8 °F - closed cup

flash_point_c

126 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges, type P3 (EN 143) respirator cartridges

Regulatory Information

危险化学品
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Certificates of Analysis (COA)

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Evaluating gas chromatography with a halogen-specific detector for the determination of disinfection by-products in drinking water.
Andersson A, et al.
Environmental Science and Pollution Research International, 119(24), 1-10 (2018)
Photodegradation of metolachlor: Isolation, identification, and quantification of monochloroacetic acid
Wilson.IR and Mabury.AS
Journal of Agricultural and Food Chemistry, 48(3), 944-950 (2000)
Determination of bromate and chlorinated haloacetic acids in bottled drinking water with chromatographic methods.
Liu Y and Mou S
Chemosphere, 55(9), 1253-1258 (2004)
Rapid simultaneous analysis of 17 haloacetic acids and related halogenated water contaminants by high-performance ion chromatography-tandem mass spectrometry.
Xue R, et al.
Analytical and Bioanalytical Chemistry, 408(24), 6613-6622 (2016)
Analysis of haloacetic acids, bromate, and dalapon in natural waters by ion chromatography-tandem mass spectrometry.
Wu S, et al.
Journal of Chromatography A, 1487(9), 100-107 (2017)

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