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Merck
CN

443395

Toluene

ACS reagent, ≥99.5%

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About This Item

Linear Formula:
C6H5CH3
CAS Number:
108-88-3
Molecular Weight:
92.14
EC Number:
203-625-9
UNSPSC Code:
12352002
PubChem Substance ID:
329756494
Beilstein/REAXYS Number:
635760
MDL number:
MFCD00008512
Assay:
≥99.5%
Grade:
ACS reagent
Bp:
110-111 °C (lit.)
Vapor pressure:
22 mmHg ( 20 °C), 26 mmHg ( 25 °C)

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InChI key

YXFVVABEGXRONW-UHFFFAOYSA-N

InChI

1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3

SMILES string

Cc1ccccc1

grade

ACS reagent

vapor density

3.2 (vs air)

vapor pressure

22 mmHg ( 20 °C), 26 mmHg ( 25 °C)

assay

≥99.5%

autoignition temp.

997 °F

expl. lim.

7 %

dilution

(for analytical testing)

impurities

H2SO4, passes test (darkened), ≤0.003% S compounds, ≤0.03% water

evapn. residue

≤0.001%

color

APHA: ≤10

refractive index

n/D 1.496 (lit.)

bp

110-111 °C (lit.)

mp

-93 °C (lit.)

density

0.865 g/mL at 25 °C (lit.)

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signalword

Danger

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Flam. Liq. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 2 Inhalation - STOT SE 3

target_organs

Central nervous system

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

39.9 °F - closed cup

flash_point_c

4.4 °C - closed cup

ppe

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

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
05862PE
03838LE
04460PD
14663JI
04640KA

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Ting Lei et al.
Small (Weinheim an der Bergstrasse, Germany), 11(24), 2946-2954 (2015-02-26)
Low-bandgap diketopyrrolopyrrole (DPP)-based polymers are used for the selective dispersion of semiconducting single-walled carbon nanotubes (s-SWCNTs). Through rational molecular design to tune the polymer-SWCNT interactions, highly selective dispersions of s-SWCNTs with diameters mainly around 1.5 nm are achieved. The influences
Murat Yücel et al.
Neuroscience and biobehavioral reviews, 32(5), 910-926 (2008-05-06)
Organic solvent abuse is associated with increased risk for serious medical, neurological, and neuropsychological impairments. While animal research suggests that exposure to organic solvents (especially toluene) may be neurotoxic, much less is known about the consequences of long-term exposure in
Marina Shalaeva et al.
Journal of medicinal chemistry, 56(12), 4870-4879 (2013-05-29)
This study demonstrates that ΔlogP(oct-tol) (difference between logP(octanol) and logP(toluene)) describes compounds propensity to form intramolecular hydrogen bonds (IMHB) and may be considered a privileged molecular descriptor for use in drug discovery and for prediction of IMHB in drug candidates.
Tayseer Mahdi et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 21(31), 11134-11142 (2015-06-26)
Frustrated Lewis pairs (FLPs) based on sterically encumbered anilines and the Lewis acid B(C6 F5 )3 were found to react with terminal alkynes effecting intermolecular hydroamination affording iminium alkynylborate species of the form [RPhNC(R')Me][R'CCB(C6 F5 )3 ]. In these cases
Yoko Yamakoshi et al.
Faraday discussions, 173, 287-296 (2014-12-04)
The photoinduced reactive oxygen species (ROS) generation from several water-soluble fullerenes was examined. Macromolecular or small molecular water-soluble fullerene complexes/derivatives were prepared and their (1)O(2) and O(2)˙(-) generation abilities were evaluated by ESR spin-trapping methods. As a result, efficient (1)O(2)
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