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Supelco

1-Octen

analytical standard

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About This Item

Lineare Formel:
CH3(CH2)5CH=CH2
CAS-Nummer:
111-66-0
Molekulargewicht:
112.21
Beilstein:
1734497
EG-Nummer:
203-893-7
MDL-Nummer:
MFCD00009548
UNSPSC-Code:
41116107
PubChem Substanz-ID:
329765954
NACRES:
NA.24

Qualität

analytical standard

Qualitätsniveau

100

Dampfdichte

3.9 (vs air)

Dampfdruck

36 mmHg ( 38 °C)

Assay

≥99.5% (GC)

Selbstzündungstemp.

446 °F

Haltbarkeit

limited shelf life, expiry date on the label

Expl.-Gr.

3.9 %

Methode(n)

HPLC: suitable
gas chromatography (GC): suitable

Brechungsindex

n20/D 1.408 (lit.)
n20/D 1.408
n20/D 1.409 (lit.)

bp

122-123 °C (lit.)

mp (Schmelzpunkt)

−101 °C (lit.)

Dichte

0.715 g/mL at 25 °C (lit.)

Anwendung(en)

cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care
petroleum

Format

neat

SMILES String

CCCCCCC=C

InChI

1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3

InChIKey

KWKAKUADMBZCLK-UHFFFAOYSA-N

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Allgemeine Beschreibung

1-Octene is a linear α-olefin and an important comonomer in the production of linear low-density polyethylene (LLDPE).
This substance is listed on the positive list of the EU regulation 10/2011 for plastics intended to come into contact with food. Find all available reference materials for compounds listed in 10/2011 here

Anwendung

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Signalwort

Danger

Gefahreneinstufungen

Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2

Zusätzliche Gefahrenhinweise

EUH066

Lagerklassenschlüssel

3 - Flammable liquids

WGK

WGK 3

Flammpunkt (°F)

50.0 °F - closed cup

Flammpunkt (°C)

10 °C - closed cup

Persönliche Schutzausrüstung

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

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Analysenzertifikate (COA)

Lot/Batch Number
BCCD0226
BCBW1887
BCBP7063V
BCBK7543V
BCBF3711V

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Ethylene tetramerization: a new route to produce 1-octene in exceptionally high selectivities
Bollmann A, et al.
Journal of the American Chemical Society, 126(45), 14712-14713 (2004)
Cristina Nerín et al.
Journal of agricultural and food chemistry, 50(25), 7488-7492 (2002-11-28)
The behavior of two synthetic adsorbents, Tenax and Porapak, as food simulants in contact with some plastic containers commercially available, recommended to be used for heating food in microwave ovens, has been studied. Containers of polycarbonate (PC), polypropylene (PP), polypropylene
A Hempel-Jørgensen et al.
Archives of environmental health, 54(2), 86-94 (1999-03-27)
In this study, we investigated the time course effect of sensory eye irritation in 16 subjects exposed (i.e., eye only) to n-butanol and 1-octene. Half the subjects were exposed to n-butanol, and the remaining subjects were exposed to 1-octene. Each
Dennis Shusterman et al.
Inhalation toxicology, 18(7), 457-471 (2006-04-11)
Irritation of the eyes, nose, and throat by airborne chemicals--also referred to as "sensory irritation"--is an important endpoint in both occupational and environmental toxicology. Modeling of human sensory irritation relies on knowledge of the physical chemistry of the compound(s) involved
Frans T I Marx et al.
Journal of molecular modeling, 15(11), 1371-1381 (2009-06-02)
The productive self-metathesis reaction of 1-octene in the presence of the Phobcat precatalyst [RuCl(2)(Phoban-Cy)(2)(=CHPh)] using density functional theory was investigated and compared to the Grubbs 1 precatalyst [RuCl(2)(PCy(3))(2)(=CHPh)]. At the GGA-PW91/DNP level, the geometry optimization of all the participating species
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