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82118

Supelco

Propylbenzene

analytical standard

Synonym(s):

1-Phenylpropane

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About This Item

Linear Formula:
C6H5CH2CH2CH3
CAS Number:
103-65-1
Molecular Weight:
120.19
Beilstein:
1903006
EC Number:
203-132-9
MDL number:
MFCD00009377
UNSPSC Code:
41116107
PubChem Substance ID:
329769237
NACRES:
NA.24

grade

analytical standard

Quality Level

100

vapor density

4.14 (vs air)

vapor pressure

2 mmHg ( 20 °C)

Assay

≥99.0% (GC)

autoignition temp.

842 °F

shelf life

limited shelf life, expiry date on the label

expl. lim.

6 %

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.491 (lit.)
n20/D 1.492

bp

159 °C (lit.)

mp

−99 °C (lit.)

density

0.862 g/mL at 25 °C (lit.)

application(s)

environmental

format

neat

SMILES string

CCCc1ccccc1

InChI

1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3

InChI key

ODLMAHJVESYWTB-UHFFFAOYSA-N

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General description

Propylbenzene belongs to the class of aromatic hydrocarbons, commonly used as a solvent in organic synthesis and precursor to synthesize intermediates such as 4-phenylbutyraldehyde and ethyl phenyl ketone.

Application

Propylbenzene may be used as an internal standard for the quantification of the vanillin in fruits and as an analytical reference standard for the quantification of the analyte in eluates of pyrolysis solid residues using different chromatography techniques.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

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Signal Word

Danger

Hazard Statements

H226,H304,H335,H411

Hazard Classifications

Aquatic Chronic 2 - Asp. Tox. 1 - Flam. Liq. 3 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 2

Flash Point(F)

107.6 °F

Flash Point(C)

42.0 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

危险化学品

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Certificates of Analysis (COA)

Lot/Batch Number

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Determination of vanillin in orange, grapefruit, tangerine, lemon, and lime juices using GC- olfactometry and GC- MS/MS
Goodner.LK, et al.
Journal of Agricultural and Food Chemistry, 48(7), 2882-2886 (2000)
Determination of aromatic compounds in eluates of pyrolysis solid residues using HS-GC-MS and DLLME-GC-MS
Bernardo.SM, et al.
Talanta, 80(1), 104-108 (2009)
W L Backes et al.
Xenobiotica; the fate of foreign compounds in biological systems, 23(12), 1353-1366 (1993-12-01)
1. Treatment of male rat with the small aromatic hydrocarbons, benzene, toluene, ethylbenzene, n-propylbenzene, m-xylene, and p-xylene increased several P450-dependent activities, with ethylbenzene, m-xylene, and n-propylbenzene producing the greatest response. Hydrocarbon treatment differentially affected toluene metabolism, producing a response dependent
M J Huertas et al.
Applied and environmental microbiology, 64(1), 38-42 (1998-01-22)
We assayed the tolerance to solvents of three toluene-degrading Pseudomonas putida strains and Pseudomonas mendocina KR1 in liquid and soil systems. P. putida DOT-T1 tolerated concentrations of heptane, propylbenzene, octanol, and toluene of at least 10% (vol/vol), while P. putida
J Schuberth
Journal of chromatographic science, 34(7), 314-319 (1996-07-01)
The full evaporation technique (FET), which is a variant of headspace analysis used to overcome matrix effects, was combined with capillary gas chromatography (GC) and ion-trap detection (ITD). The aim was to enable quantitative tests of volatile organic compounds (VOCs)
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