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Sigma-Aldrich

4-(Trifluoromethyl)cyclohexanone

97%

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About This Item

Empirical Formula (Hill Notation):
C7H9F3O
CAS Number:
75091-99-5
Molecular Weight:
166.14
MDL number:
MFCD00102145
UNSPSC Code:
12352100
PubChem Substance ID:
329766769
NACRES:
NA.22

Quality Level

100

Assay

97%

form

liquid

refractive index

n20/D 1.400

density

1.221 at 25 °C

functional group

fluoro
ketone

SMILES string

FC(F)(F)C1CCC(=O)CC1

InChI

1S/C7H9F3O/c8-7(9,10)5-1-3-6(11)4-2-5/h5H,1-4H2

InChI key

IPQDZFUZVJKAKZ-UHFFFAOYSA-N

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Pictograms

Environment
GHS09

Signal Word

Warning

Hazard Statements

H400

Precautionary Statements

P273

Hazard Classifications

Aquatic Acute 1

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

170.1 °F

Flash Point(C)

76.7 °C

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Certificates of Analysis (COA)

Lot/Batch Number
MKCP6753
MKCN9330
MKCL4911
MKCH8570
MKBW8947V

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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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