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161365

Sigma-Aldrich

3,4-Dichlorotoluene

97%

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About This Item

Linear Formula:
CH3C6H3Cl2
CAS Number:
95-75-0
Molecular Weight:
161.03
Beilstein:
1931687
EC Number:
202-447-9
MDL number:
MFCD00000556
UNSPSC Code:
12352100
PubChem Substance ID:
24849924
NACRES:
NA.22

Quality Level

100

Assay

97%

refractive index

n20/D 1.547 (lit.)

bp

200.5 °C/741 mmHg (lit.)

density

1.251 g/mL at 25 °C (lit.)

functional group

chloro

SMILES string

Cc1ccc(Cl)c(Cl)c1

InChI

1S/C7H6Cl2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3

InChI key

WYUIWKFIFOJVKW-UHFFFAOYSA-N

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General description

3,4-Dichlorotoluene is added as growth supplement in culture medium of Ralstonia sp. strain PS12.

Application

3,4-Dichlorotoluene was used in determination of enthalpy of formation for molecular complexes of I2 with chloromethylbenzene molecules in CCl4.

Pictograms

Environment
GHS09

Hazard Statements

H411

Precautionary Statements

P273 - P391 - P501

Hazard Classifications

Aquatic Chronic 2

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

185.0 °F

Flash Point(C)

85 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
00421EJ
1915EL
09419AS
08320MS
30705040

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Thermochemistry of molecular complexes. 4. Molecular complexes of I2 with chloromethylbenzenes.
Greaux JB, et al.
J. Incl. Phenom. Mol. Recog. Chem., 13(3), 245-248 (1992)
Katrin Pollmann et al.
Journal of bacteriology, 184(19), 5261-5274 (2002-09-10)
Ralstonia sp. strain PS12 is able to use 2,4-, 2,5-, and 3,4-dichlorotoluene as growth substrates. Dichloromethylcatechols are central intermediates that are formed by TecA tetrachlorobenzene dioxygenase-mediated activation at two adjacent unsubstituted carbon atoms followed by TecB chlorobenzene dihydrodiol dehydrogenase-catalyzed rearomatization

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