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Merck
CN

53160

Hexylbenzene

purum, ≥98.0% (GC)

Synonym(s):

1-Phenylhexane

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About This Item

Linear Formula:
C6H5(CH2)5CH3
CAS Number:
1077-16-3
Molecular Weight:
162.27
EC Number:
214-070-7
UNSPSC Code:
12352100
PubChem Substance ID:
329757917
Beilstein/REAXYS Number:
1904786
MDL number:
MFCD00009526

Key Documents

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InChI key

LTEQMZWBSYACLV-UHFFFAOYSA-N

InChI

1S/C12H18/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4,6,9H2,1H3

SMILES string

CCCCCCc1ccccc1

grade

purum

assay

≥98.0% (GC)

bp

226 °C (lit.)

mp

−61 °C (lit.)

density

0.861 g/mL at 25 °C (lit.)

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pictograms

Exclamation markEnvironment
GHS07,GHS09

signalword

Warning

Hazard Classifications

Aquatic Acute 1 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

181.4 °F - closed cup

flash_point_c

83 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Hiroshi Kobayashi et al.
Journal of chromatography. A, 1109(1), 2-9 (2005-12-20)
The contribution of molecular diffusion to peak broadening was studied in a reversed-phase HPLC system, consisting of a monolithic silica C18 column and methanol-water mobile phase. Study on the band broadening effect of holding a solute in a column or
Metabolism of n-butyl, n-hexyl, and n-octyl benzene in the bile of rainbow trout.
J Hellou et al.
Bulletin of environmental contamination and toxicology, 39(2), 182-187 (1987-08-01)
Yi Min et al.
Journal of chromatography. A, 1356, 148-156 (2014-07-08)
In this work, 1.9 μm reversed-phase packing materials with superficially porous structure were prepared to achieve the rapid and high efficient separation of peptides and proteins. The silica particles were synthesized via three steps, nonporous silica particle preparation by a

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