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36742

Supelco

1,2,3-Trichlorobenzene

PESTANAL®, analytical standard

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About This Item

Empirical Formula (Hill Notation):
C6H3Cl3
CAS Number:
87-61-6
Molecular Weight:
181.45
Beilstein/REAXYS Number:
956882
EC Number:
201-757-1
MDL number:
MFCD00000537
UNSPSC Code:
41116107
PubChem Substance ID:
329755488

grade

analytical standard

Quality Level

100

vapor density

6.25 (vs air)

vapor pressure

0.07 mmHg ( 25 °C)

product line

PESTANAL®

autoignition temp.

1059 °F

shelf life

limited shelf life, expiry date on the label

expl. lim.

6.6 %

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

bp

218-219 °C (lit.)

mp

51-53 °C (lit.)

application(s)

agriculture
environmental

format

neat

SMILES string

Clc1cccc(Cl)c1Cl

InChI

1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H

InChI key

RELMFMZEBKVZJC-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.

Legal Information

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

pictograms

Exclamation markEnvironment
GHS07,GHS09

signalword

Warning

hcodes

H317,H410

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Skin Sens. 1B

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

260.6 °F - closed cup

flash_point_c

127.0 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BCCC9430
SZBF187XV
SZBF099XV
SZB8204XV
SZE8204X

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Roger Lille-Langøy et al.
Toxicology and applied pharmacology, 284(1), 54-64 (2015-02-15)
Many persistent organic pollutants (POPs) accumulate readily in polar bears because of their position as apex predators in Arctic food webs. The pregnane X receptor (PXR, formally NR1I2, here proposed to be named promiscuous xenobiotic receptor) is a xenobiotic sensor
Hongmei Hu et al.
Journal of chromatographic science, 52(5), 375-382 (2013-05-07)
A simple, rapid, sensitive and high throughput method is described, based on solid-phase disk extraction (SPDE) and gas chromatography-electron capture detection, for the determination of chlorobenzens (CBs) in water samples. The proposed SPDE sample pretreatment method was initially optimized and
A A Toropov et al.
European journal of medicinal chemistry, 43(4), 714-740 (2007-07-17)
Simplified molecular input line entry system (SMILES) has been utilized in constructing quantitative structure-property relationships (QSPR) for octanol/water partition coefficient of vitamins and organic compounds of different classes by optimal descriptors. Statistical characteristics of the best model (vitamins) are the
Brian D Fitz et al.
Journal of chromatography. A, 1392, 82-90 (2015-03-31)
Low thermal mass gas chromatography (LTM-GC) was evaluated for rapid, high peak capacity separations with three injection methods: liquid, headspace solid phase micro-extraction (HS-SPME), and direct vapor. An Agilent LTM equipped with a short microbore capillary column was operated at

Protocols

US EPA Method 8260: GC Analysis of Volatiles on SPB®-624 after Purge & Trap using "K" Trap, Fast GC Analysis

US EPA Method 8260 describes the analysis of volatile organic compounds in solid wastes and ground waters. This application illustrates the analysis of many compounds commonly analyzed by this method using purge and trap coupled to GC-MS.

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