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35350

Sigma-Aldrich

1,3-Dichlorobenzene

puriss., ≥99.0% (GC)

Synonym(s):

m-Dichlorobenzene

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About This Item

Empirical Formula (Hill Notation):
C6H4Cl2
CAS Number:
541-73-1
Molecular Weight:
147.00
Beilstein:
956618
EC Number:
208-792-1
MDL number:
MFCD00000573
UNSPSC Code:
12352100
PubChem Substance ID:
57649296
NACRES:
NA.22

vapor pressure

5 mmHg ( 38.8 °C)

grade

puriss.

Assay

≥99.0% (GC)

form

liquid

refractive index

n20/D 1.546 (lit.)
n20/D 1.546

bp

172-173 °C (lit.)

mp

−25-−22 °C (lit.)

density

1.288 g/mL at 25 °C (lit.)

SMILES string

Clc1cccc(Cl)c1

InChI

1S/C6H4Cl2/c7-5-2-1-3-6(8)4-5/h1-4H

InChI key

ZPQOPVIELGIULI-UHFFFAOYSA-N

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General description

1,3-Dichlorobenzene is a thermodynamically favoured isomer of 1,4-dichlorobenzene. The heat capacity at constant pressure and density of 1,3-dichlorobenzene was measured in the temperature range from (283.15 to 353.15)K.

Application

1,3-Dichlorobenzene is suitable as carbon and energy supplement for the growth of gram-negative, peritrichously flagellated rod, tentatively identified as an Alcaligenes sp.

Pictograms

Exclamation markEnvironment
GHS07,GHS09

Signal Word

Warning

Hazard Statements

H302,H411

Precautionary Statements

P273 - P301 + P312 + P330

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Chronic 2

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

152.6 °F - closed cup

Flash Point(C)

67.0 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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J A de Bont et al.
Applied and environmental microbiology, 52(4), 677-680 (1986-10-01)
A gram-negative, peritrichously flagellated rod, tentatively identified as an Alcaligenes sp., was isolated from a mixture of soil and water samples by using 1,3-dichlorobenzene as the sole carbon and energy source. During growth on 1,3-dichlorobenzene, almost stoichiometric amounts of chloride
Heat capacities and densities of some liquid chloro-, bromo-, and bromochloro-substituted benzenes.
Goralski P and Piekarski H.
Journal of Chemical and Engineering Data, 52(2), 655-659 (2007)
J Messner et al.
Chemical communications (Cambridge, England), 50(79), 11705-11708 (2014-08-22)
The isomerisation reaction of 1,4-dichlorobenzene leading to the thermodynamically favoured and technically desired 1,3-dichlorobenzene has been studied comparing highly acidic chloroaluminate melts with organic imidazolium and alkali metal ions. Interestingly, the inorganic melts show much higher reactivity and full recyclability
Michael Bunge et al.
Environmental microbiology, 10(10), 2670-2683 (2008-07-17)
Enrichment cultures capable of reductively dechlorinating 1,2,4-trichlorodibenzo-p-dioxin (1,2,4-TrCDD) were shown to dechlorinate 1,2,3-trichlorobenzene (1,2,3-TrCB) to 1,3-dichlorobenzene. To test if this activity can be used to enrich for dioxin-dechlorinating bacteria, a two-liquid phase cultivation with 200 mM 1,2,3-TrCB dissolved in hexadecane
D Mahadevan et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 79(5), 962-969 (2011-05-13)
The FT-IR and FT-Raman vibrational spectra of 1,3-dichlorobenzene (1,3-DCB) have been recorded using Bruker IFS 66 V Spectrometer in the range 4000-100 cm(-1). A detailed vibrational spectral analysis has been carried out and assignments of the observed fundamental bands have
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