113182

Sigma-Aldrich

1-Phenylheptane

98%

Synonym(s):
Heptylbenzene
Linear Formula:
C6H5(CH2)6CH3
CAS Number:
Molecular Weight:
176.30
Beilstein/REAXYS Number:
1905782
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

98%

refractive index

n20/D 1.485 (lit.)

bp

233 °C (lit.)

mp

−48 °C (lit.)

density

0.86 g/mL at 25 °C (lit.)

SMILES string

CCCCCCCc1ccccc1

InChI

1S/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3

InChI key

LBNXAWYDQUGHGX-UHFFFAOYSA-N

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General description

Heptylbenzene (1-Phenylheptane) forms charge-transfer complexes with fluoranil and 1,3,5-trinitrobenzene.

Application

1-Phenylheptane is used in zirconia and titania based stationary phase capillary HTLC, to separate alkyl benzene derivatives using an acetonitrile-water eluent.

Packaging

25, 100 g in glass bottle

Pictograms

Environment

Signal Word

Warning

Hazard Statements

Personal Protective Equipment

dust mask type N95 (US),Eyeshields,Gloves

RIDADR

UN 3082 9 / PGIII

WGK Germany

WGK 3

Flash Point(F)

203.0 °F - closed cup

Flash Point(C)

95 °C - closed cup

Certificate of Analysis

Certificate of Origin

Hot eluent capillary liquid chromatography using zirconia and titania based stationary phases.
Kephart TS, et al.
Analytica Chimica Acta, 414(1-2), 71-78 (2000)
Giorgia Purcaro et al.
Analytica chimica acta, 1027, 158-167 (2018-06-06)
Untargeted metabolomics study of volatile organic compounds produced by different cell cultures is a field that has gained increasing attention over the years. Solid-phase microextraction has been the sampling technique of choice for most of the applications mainly due to...
K Elias Ikonen et al.
Journal of chromatography. A, 1614, 460705-460705 (2019-11-23)
An update for ASTM D2425, "Standard Test Method for Hydrocarbon Types in Middle Distillates by Mass Spectrometry," was recently released to expand its scope by adding modern mass spectrometric instrumentation and a new sample type, synthesized hydrocarbons. While the method...

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