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Sigma-Aldrich

4-Ethylcyclohexanone

97%

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About This Item

Linear Formula:
C2H5C6H9(=O)
CAS Number:
5441-51-0
Molecular Weight:
126.20
Beilstein/REAXYS Number:
1924964
EC Number:
226-629-2
MDL number:
MFCD00001644
UNSPSC Code:
12352100
PubChem Substance ID:
24847900
NACRES:
NA.22

assay

97%

form

liquid

refractive index

n20/D 1.452 (lit.)

bp

192-194 °C (lit.)

density

0.895 g/mL at 25 °C (lit.)

SMILES string

CCC1CCC(=O)CC1

InChI

1S/C8H14O/c1-2-7-3-5-8(9)6-4-7/h7H,2-6H2,1H3

InChI key

OKSDJGWHKXFVME-UHFFFAOYSA-N

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Application

4-Ethylcyclohexanone was used to study the biotransformations of 4-Ethylcyclohexanone.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Aquatic Chronic 3 - Skin Irrit. 2 - Skin Sens. 1

Storage Class

10 - Combustible liquids

wgk_germany

WGK 1

flash_point_f

145.4 °F

flash_point_c

63 °C

ppe

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)

Certificates of Analysis (COA)

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Miyazawa M, et al.
Journal of Chemical Technology and Biotechnology, 75(2), 143-146 (2000)
Qinglei Meng et al.
Nature communications, 8, 14190-14190 (2017-02-01)
Cyclohexanone and its derivatives are very important chemicals, which are currently produced mainly by oxidation of cyclohexane or alkylcyclohexane, hydrogenation of phenols, and alkylation of cyclohexanone. Here we report that bromide salt-modified Pd/C in H

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