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29135

Supelco

Cyclohexanone

Selectophore, ≥99.5%

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About This Item

Linear Formula:
C6H10(=O)
CAS Number:
Molecular Weight:
98.14
Beilstein:
385735
EC Number:
MDL number:
UNSPSC Code:
26111700
PubChem Substance ID:
NACRES:
NB.61

grade

for ion-selective electrodes

Quality Level

vapor density

3.4 (vs air)

vapor pressure

3.4 mmHg ( 20 °C)

description

solvent for preparation of membranes

product line

Selectophore

Assay

≥99.5% (GC)
≥99.5%

autoignition temp.

788 °F

expl. lim.

1.1 %, 100 °F
9.4 %

impurities

≤0.1% water

refractive index

n20/D 1.450 (lit.)
n20/D 1.451

bp

155 °C (lit.)

mp

−47 °C (lit.)

density

0.947 g/mL at 25 °C (lit.)

SMILES string

O=C1CCCCC1

InChI

1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2

InChI key

JHIVVAPYMSGYDF-UHFFFAOYSA-N

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General description

Cyclohexanone is an industrially important reagent. It is also a major intermediate in the synthesis of nylon.
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Other Notes

Solvent for preparing ion-selective membranes for microelectrodes; it is less volatile than other solvents

Legal Information

Selectophore is a trademark of Merck KGaA, Darmstadt, Germany

Signal Word

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

111.2 °F - closed cup

Flash Point(C)

44 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Selective phenol hydrogenation to cyclohexanone over a dual supported Pd-Lewis acid catalyst.
Liu H
Science, 326 (5957), 1250-1252 (2009)
Effect of hydrogen sulphide on the hydrodeoxygenation of aromatic and aliphatic oxygenates on sulphided catalysts.
Senol OI
J. Mol. Catal. A: Chem., 277 (1), 107-112 (2007)
U. Schaller et al.
Pflugers Archiv : European Journal of Physiology (1993)
Viktória Fábos et al.
Chemistry, an Asian journal, 7(11), 2629-2637 (2012-09-07)
Iron (and to a lesser extent manganese) in the wall of a 316 stainless steel (SS) reactor is responsible for the hydrogenation of cyclohexanone to cyclohexanol when using an aqueous formic acid solution under high temperature and pressure water (HTPW)
Application of fragment screening and merging to the discovery of inhibitors of the Mycobacterium tuberculosis cytochrome P450 CYP121.
Sean A Hudson et al.
Angewandte Chemie (International ed. in English), 51(37), 9311-9316 (2012-08-15)

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