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Merck
CN

D90601

1,2-Diethylbenzene

technical grade, 92%

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About This Item

Linear Formula:
C6H4(C2H5)2
CAS Number:
Molecular Weight:
134.22
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
205-170-1
Beilstein/REAXYS Number:
1904392
MDL number:
Assay:
92%
Form:
liquid
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grade

technical grade

Quality Level

assay

92%

form

liquid

autoignition temp.

743 °F

refractive index

n20/D 1.502 (lit.)

bp

183 °C (lit.)

mp

−31 °C (lit.)

density

0.88 g/mL at 25 °C (lit.)

SMILES string

CCc1ccccc1CC

InChI

1S/C10H14/c1-3-9-7-5-6-8-10(9)4-2/h5-8H,3-4H2,1-2H3

InChI key

KVNYFPKFSJIPBJ-UHFFFAOYSA-N



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pictograms

Flame

signalword

Warning

hcodes

Hazard Classifications

Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk

WGK 2

flash_point_f

131.0 °F - closed cup

flash_point_c

55 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Jean-Paul Payan et al.
Archives of toxicology, 82(9), 591-600 (2008-02-07)
The bio-distribution of the neurotoxic 1,2-diethylbenzene (1,2-DEB) was studied in male Sprague-Dawley rats after intravenous administration of [(14)C] 1,2-DEB (1 mg kg(-1)). The highest concentrations of [(14)C] non-volatile metabolites, determined by whole-body auto-radiography, were in the nasal cavity, ethmoid turbinates
I Linhart et al.
Xenobiotica; the fate of foreign compounds in biological systems, 26(12), 1263-1272 (1996-12-01)
1. Biotransformation of 1,2-diethenylbenzene (1) in rat was studied. Five urinary metabolites were isolated by extraction of acid hydrolysed urine and identified by nmr and mass spectroscopy, namely, 1-(2-ethenylphenyl)ethane-1,2-diol (2) 2-ethenylmandelic acid (3), 2-ethenylphenylglyoxylic acid (4), 2-ethenylphenylacetylglycine (5) N-acetyl-S-[1-(2-ethenylphenyl)-2-hydroxyethyl]cysteine (6)
J P Payan et al.
Drug metabolism and disposition: the biological fate of chemicals, 29(6), 868-876 (2001-05-17)
In a previous study, it was shown that the neurotoxic compound 1,2-diethylbenzene (1,2-DEB) is mainly hydroxylated in the alkyl chain to give 1-(2'-ethylphenyl)ethanol (1,2-EPE) and excreted in urine of rats as two glucuronide compounds (GA1 and GA2). Some findings have



Global Trade Item Number

SKUGTIN
D90601-5G04061837709210
D90601-25G04061837709203