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75091-99-5

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75091-99-5 Usage

Uses

4-(Trifluoromethyl)cyclohexanone (cas# 75091-99-5) is a compound useful in organic synthesis.

Check Digit Verification of cas no

The CAS Registry Mumber 75091-99-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,5,0,9 and 1 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 75091-99:
(7*7)+(6*5)+(5*0)+(4*9)+(3*1)+(2*9)+(1*9)=145
145 % 10 = 5
So 75091-99-5 is a valid CAS Registry Number.
InChI:InChI=1/C7H9F3O/c8-7(9,10)5-1-3-6(11)4-2-5/h5H,1-4H2

75091-99-5 Well-known Company Product Price

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  • Alfa Aesar

  • (H33793)  4-(Trifluoromethyl)cyclohexanone, 97%   

  • 75091-99-5

  • 1g

  • 1795.0CNY

  • Detail
  • Alfa Aesar

  • (H33793)  4-(Trifluoromethyl)cyclohexanone, 97%   

  • 75091-99-5

  • 10g

  • 8974.0CNY

  • Detail

75091-99-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(Trifluoromethyl)cyclohexanone

1.2 Other means of identification

Product number -
Other names 4-(trifluoromethyl)cyclohexan-1-one

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:75091-99-5 SDS

75091-99-5Relevant articles and documents

Csp3-H Trifluoromethylation of Unactivated Aliphatic Systems

He, Jiachen,Nguyen, Truong N.,Guo, Shuo,Cook, Silas P.

supporting information, p. 702 - 705 (2021/02/01)

A straightforward method for the undirected trifluoromethylation of unactivated methylene units was developed. The reaction proceeds in aqueous acetonitrile with Grushin's reagent, bpyCu(CF3)3, under broad-spectrum white-light irradiation. The trifluoromethylation tolerates a wide range of functional groups including ketones, esters, nitriles, amides, alcohols, and carboxylic acids. The C-H cleavage step is performed via intermolecular H atom abstraction, and the selectivities across a range of methylene units are reported. Mechanistic studies offer a general reaction coordinate for the overall transformation.

Synthesis method of 4-substituent cyclohexanone liquid crystal intermediate

-

Paragraph 0056-0058, (2021/05/19)

The invention discloses a synthesis method of a 4-substituent cyclohexanone liquid crystal intermediate, which comprises the following step: carrying out oxidation catalytic reaction on 4-substituent cyclohexanol under the action of trichloroisocyanide urea to obtain the 4-substituent cyclohexanone liquid crystal intermediate. The method is high in reaction selectivity, high in yield, environment-friendly, simple in post-treatment and suitable for industrial production.

Spectroscopic and X-ray crystallographic evidence for electrostatic effects in 4-substituted cyclohexanone-derived hydrazones, imines, and corresponding salts

Dibble, David J.,Ziller, Joseph W.,Woerpef

, p. 7706 - 7719 (2011/12/02)

The axial conformer of several 4-substituted cyclo-hexanone hydrazone salts was found to predominate in solution. Changes in the charge of the molecule and the polarity of the solvent led to changes in the conformational preference of each molecule that were consistent with electrostatic stabilization of the axial conformer. H NMR spectroscopic analysis was utilized to determine the structure of cyclohexanone-derived substrates by comparison to conformationally restricted trans-decalone derivatives and computational models. X-ray crystallography demonstrated that the axial configuration of a pendant benzyloxy group is the preferred conformation of an iminium ion in the solid state. The structure of a neutral hydrazone was also determined to favor the axial configuration for a pendant benzyloxy group in the solid state.

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