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Merck

T54607

1,3,5-Trichlorobenzene

99%

Synonym(s):

Symmetrical trichlorobenzene, s-Trichlorobenzene

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About This Item

Empirical Formula (Hill Notation):
C6H3Cl3
CAS Number:
Molecular Weight:
181.45
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-608-6
Beilstein/REAXYS Number:
1635233
MDL number:
Assay:
99%
Form:
powder or crystals
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Quality Level

assay

99%

form

powder or crystals

bp

208 °C (lit.)

mp

56-60 °C (lit.)

SMILES string

Clc1cc(Cl)cc(Cl)c1

InChI

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

InChI key

XKEFYDZQGKAQCN-UHFFFAOYSA-N

Application

1,3,5-Trichlorobenzene can be used to synthesize:
  • Bis(3,5-dichloro-4-pyridyl)(2,4,6-trichlorophenyl)methyl radical, a stable, photoluminescent organic radical.
  • Solution-processable graphene quantum dots as light absorbers for photovoltaics.
  • π-conjugated polydentate ligand, hexakis(2-pyridyl)dipyrazinoquinoxaline (HPDQ) as a highly selective on/off fluorescence sensor for cadmium (II) ions.
  • Two-dimensional chlorine-substituted graphdiyne (Cl-GDY) as an electrode material for lithium-ion batteries.



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pictograms

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Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Chronic 2

Storage Class

11 - Combustible Solids

flash_point_f

224.6 °F - closed cup

flash_point_c

107 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves



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Large, solution-processable graphene quantum dots as light absorbers for photovoltaics.
Yan X, et al.
Nano Letters, 10(5), 1869-1873 (2010)
A highly selective on/off fluorescence sensor for cadmium (II).
Zhao Q, et al.
Inorganic Chemistry, 50(20), 10041-10046 (2011)
A luminescent organic radical with two pyridyl groups: high photostability and dual stimuli-responsive properties, with theoretical analyses of photophysical processes.
Kimura S, et al.
Chemical Science, 9(7), 1996-2007 (2018)