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Cyclohexanol, 4-(1,1-dimethylethyl)-, 4-methylbenzenesulfonate, trans- is a complex organic compound with the chemical formula C16H26O3S. It is a derivative of cyclohexanol, where a 1,1-dimethylethyl group is attached to the 4-position, and a 4-methylbenzenesulfonate group is esterified to the hydroxyl group. Cyclohexanol, 4-(1,1-dimethylethyl)-, 4-methylbenzenesulfonate, trans- is characterized by its trans-configuration, indicating the relative positions of the substituents around the double bond in the molecule. It is an important intermediate in the synthesis of various pharmaceuticals and agrochemicals, and is also used in the preparation of specialty chemicals and fragrances. Due to its complex structure and specific functional groups, it is a valuable compound in the field of organic chemistry and chemical engineering.

7453-05-6

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7453-05-6 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 7453-05-6 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 7,4,5 and 3 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 7453-05:
(6*7)+(5*4)+(4*5)+(3*3)+(2*0)+(1*5)=96
96 % 10 = 6
So 7453-05-6 is a valid CAS Registry Number.

7453-05-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name trans-4-tert-butylcyclohexyl 4-toluenesulfonate

1.2 Other means of identification

Product number -
Other names Toluol-4-sulfonsaeure-(trans-4-tert-butyl-cyclohexylester)

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:7453-05-6 SDS

7453-05-6Relevant academic research and scientific papers

1,4-Diazabicyclo[2.2.2]octane (DABCO)- an efficient reagent in the synthesis of alkyl tosylates or sulfenates

Hartung, Jens,Huenig, Siegfried,Kneuer, Rainer,Schwarz, Michaela,Wenner, Hermann

, p. 1433 - 1438 (1997)

The bieyclic tertiary amine 1,4-diazabicyclo[2.2.2]octane (DABCO) is 8 promising substitute not only for the widely used but hazardous and hygroscopic base pyridine in the syntheses of alkyl tosylates 3 but also for triethylamine in the preparation of alk

Epimerization of Tertiary Carbon Centers via Reversible Radical Cleavage of Unactivated C(sp3)-H Bonds

Wang, Yaxin,Hu, Xiafei,Morales-Rivera, Cristian A.,Li, Guo-Xing,Huang, Xin,He, Gang,Liu, Peng,Chen, Gong

supporting information, p. 9678 - 9684 (2018/07/21)

Reversible cleavage of C(sp3)-H bonds can enable racemization or epimerization, offering a valuable tool to edit the stereochemistry of organic compounds. While epimerization reactions operating via cleavage of acidic C(sp3)-H bonds, such as the Cα-H of carbonyl compounds, have been widely used in organic synthesis and enzyme-catalyzed biosynthesis, epimerization of tertiary carbons bearing a nonacidic C(sp3)-H bond is much more challenging with few practical methods available. Herein, we report the first synthetically useful protocol for the epimerization of tertiary carbons via reversible radical cleavage of unactivated C(sp3)-H bonds with hypervalent iodine reagent benziodoxole azide and H2O under mild conditions. These reactions exhibit excellent reactivity and selectivity for unactivated 3° C-H bonds of various cycloalkanes and offer a powerful strategy for editing the stereochemical configurations of carbon scaffolds intractable to conventional methods. Mechanistic study suggests that the unique ability of N3? to serve as a catalytic H atom shuttle is critical to reversibly break and reform 3° C-H bonds with high efficiency and selectivity.

Low-temperature x-ray structural studies of the ester and ether derivatives of cis- and trans-4-tert-butyl cyclohexanol and 2-adamantanol: Application of the variable oxygen probe to determine the relative σ-donor ability of C-H and C-C bonds

Spiniello, Marisa,White, Jonathan M.

, p. 3094 - 3101 (2007/10/03)

Results of low-temperature X-ray structural studies for five cis-, and three trans-4-tert-butyl cyclohexanol, and six 2-adamantanol ester and ether derivatives are reported. Plots of C-OR bond distance against pKa(ROH) for derivatives of axial alcohol (5), equatorial alcohol (6) and 2-adamantanol derivatives (7) give slopes of -2.77 × 10-3, -2.86 × 10-3 and -3.05 × 10-3, respectively. Given that the relative differences in the slopes are modest, no clear distinction can be made about the relative σ-donor ability of a C-H bond and a C-C bond.

Acid-catalyzed Rearrangement of O-4-tert-Butylcyclohexyl Methylthiocarbamates

Fujii, Kunio,Shuto, Yoshihiro,Kinoshita, Yoshiro

, p. 2379 - 2384 (2007/10/02)

The geometrical isomers of O-4-tert-butylcyclohexyl methylthiocarbamate were prepared by way of the corresponding dithiocarbamates.The O-trans-isomer was obtained from a mixture of cis- and trans-4-tert-butylcyclohexanols via an alkoxide formation involvi

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