74902
1-Octene
purum, ≥97.0% (GC)
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About This Item
Linear Formula:
CH3(CH2)5CH=CH2
CAS Number:
Molecular Weight:
112.21
EC Number:
203-893-7
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
1734497
MDL number:
Product Name
1-Octene, purum, ≥97.0% (GC)
InChI key
KWKAKUADMBZCLK-UHFFFAOYSA-N
InChI
1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3
SMILES string
CCCCCCC=C
vapor density
3.9 (vs air)
vapor pressure
36 mmHg ( 38 °C)
grade
purum
assay
≥97.0% (GC)
form
liquid
autoignition temp.
446 °F
expl. lim.
3.9 %
refractive index
n20/D 1.408 (lit.)
n20/D 1.409 (lit.)
n20/D 1.409
bp
122-123 °C (lit.)
mp
−101 °C (lit.)
density
0.715 g/mL at 25 °C (lit.)
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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
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
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
I N White et al.
Biochemical pharmacology, 35(9), 1569-1575 (1986-05-01)
The enzymic activation of a model olefin oct-1-ene was studied in rat liver microsomal systems in vitro. An active metabolite was trapped using N-acetylcysteine and identified by means of capillary GLC/mass spectrometry and 360 MHz 1H NMR as S-3-oxo-octyl-N-acetylcysteine. A
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