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Merck
CN

134449

p-Xylene

ReagentPlus®, 99%

Synonym(s):

1,4-Dimethylbenzene

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About This Item

Linear Formula:
C6H4(CH3)2
CAS Number:
Molecular Weight:
106.17
UNSPSC Code:
12352005
NACRES:
NA.21
PubChem Substance ID:
EC Number:
203-396-5
Beilstein/REAXYS Number:
1901563
MDL number:
Assay:
99%
Technique(s):
GC/MS: suitable
Bp:
138 °C (lit.)
Vapor pressure:
9 mmHg ( 20 °C)
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vapor density

3.7 (vs air)

Quality Level

vapor pressure

9 mmHg ( 20 °C)

product line

ReagentPlus®

assay

99%

form

liquid

autoignition temp.

984 °F

expl. lim.

7 %

technique(s)

GC/MS: suitable

refractive index

n20/D 1.495 (lit.)

bp

138 °C (lit.)

mp

12-13 °C (lit.)

solubility

water: soluble 0.2 g/L

density

0.861 g/mL at 20 °C (lit.)

SMILES string

Cc1ccc(C)cc1

InChI

1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3

InChI key

URLKBWYHVLBVBO-UHFFFAOYSA-N

General description

p-Xylene is an isomeric form of xylene. It undergoes Friedel-Crafts acylation reaction with various acids in the presence of zeolites (catalyst). It can be obtained from the mixtures of isomeric forms of xylene and ethylbenzene isolated from the naptha fraction of petroleum. Also, it can be prepared from toluene by employing ZSM (Zeolite Socony Mobil)-5 catalysts. It is a raw material for the manufacture of PET (poly(ethylene terephthalate)) bottles. Its sustainable synthesis from ethylene and dimethylfuran in the presence of zeolite catalysts has been reported.

Application

p-Xylene may be used in the synthesis of poly-p-xylene and terephthalic acid.
p-xylene mayumb be used in the single drop microextraction of the corresponding organochlorine pesticides in vegetables, separated via gas chromatography(GC)coupled with mass spectrometry(MS).

Legal Information

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


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signalword

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Aquatic Chronic 3 - Asp. Tox. 1 - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

80.6 °F - closed cup

flash_point_c

27 °C - closed cup

Regulatory Information

危险化学品

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Mixed liquids for single-drop microextraction of organochlorine pesticides in vegetables
Zhang M, et al.
Talanta, 74(4), 599-604 (2008)
Ultra-selective cycloaddition of dimethylfuran for renewable p-xylene with H-BEA.
Chang CC, et al.
Green Chemistry, 16(2), 585-588 (2014)
Cycloaddition of biomass-derived furans for catalytic production of renewable p-xylene.
Williams CL, et al.
ACS Catalysis, 2(6), 935-939 (2012)



Global Trade Item Number

SKUGTIN
T2751-5G04061837343100
75935-50MG04061832916934
T2751-100MG04061832393377
T2751-10MG04061832393384
T2751-1G04061837343087
T2751-250MG04061837343094
PHR3245-500MG04065267005478
1642904-200MG04061833855423
134449-20L04061837713194
134449-18L-CS04061837713187
134449-1L04061838730060
134449-4L04061838730077