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Cyclopentanecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester, commonly known as tert-butyl cyclopentanone, is a chemical compound that is an ester derivative of cyclopentanecarboxylic acid. It is characterized by its pleasant, fruity odor and is known for its low toxicity, making it relatively safe to handle and use.

174195-95-0

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174195-95-0 Usage

Uses

Used in Pharmaceutical and Agrochemical Synthesis:
Cyclopentanecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester is used as an intermediate in the synthesis of various pharmaceuticals and agrochemicals. Its unique chemical structure allows for the development of new compounds with potential therapeutic and pesticidal properties.
Used in Flavor and Fragrance Production:
Due to its pleasant, fruity odor, tert-butyl cyclopentanone is used in the production of flavors and fragrances. It can be incorporated into a wide range of products, including food, beverages, cosmetics, and perfumes, to enhance their sensory characteristics.
Used as an Industrial Solvent:
Cyclopentanecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester is also utilized as a solvent in various industrial applications. Its ability to dissolve a wide range of substances makes it a versatile component in the manufacturing process of different products, such as paints, coatings, and adhesives.
Used in Chemical Research:
Tert-butyl cyclopentanone's unique properties and reactivity make it a valuable compound in chemical research. It can be used as a starting material or a reagent in the synthesis of various organic compounds, contributing to the advancement of chemical knowledge and the development of new technologies.

Check Digit Verification of cas no

The CAS Registry Mumber 174195-95-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,4,1,9 and 5 respectively; the second part has 2 digits, 9 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 174195-95:
(8*1)+(7*7)+(6*4)+(5*1)+(4*9)+(3*5)+(2*9)+(1*5)=160
160 % 10 = 0
So 174195-95-0 is a valid CAS Registry Number.

174195-95-0SDS

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 tert-butyl 3-oxocyclopentane-1-carboxylate

1.2 Other means of identification

Product number -
Other names Rac-3-Oxo-cyclopentanecarboxylic acid tert-butyl ester

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:174195-95-0 SDS

174195-95-0Relevant academic research and scientific papers

Building the Housane: Diastereoselective Synthesis and Characterization of Bicyclo[2.1.0]pentane Carboxylic Acids

Grygorenko, Oleksandr O.,Iminov, Rustam T.,Lutsenko, Dmytro O.,Semeno, Volodymyr V.,Vashchenko, Bohdan V.,Vasylchenko, Vadym O.,Volovenko, Olesia B.

, (2020)

An approach to 1,3-disubstitued bicyclo[2.1.0]pentane (housane) derivatives was developed. The method relied on lithium bis(trimethylsilyl)amide-mediated intramolecular cyclization of trisubstitued cyclopentane carboxylates bearing a leaving group (at the C-4 position) and an additional substituent (at the C-3 atom), in turn synthesized from cyclopent-3-ene carboxylate. The synthetic sequence allowed for the preparation of both cis- and trans-1,3-disubstituted housane-1-carboxylic acids in diastereoselective manner on up to 80 g scale. In particular, bicyclic γ-amino acids - γ-aminobutyric acid analogues - were synthesized. It was shown that the bicyclo[2.1.0]pentane did not significantly affect pKa of the corresponding derivatives and slightly increased their hydrophilicity (by 0.07-0.25 Log P units) as compared to cyclopentane. X-ray diffraction studies showed that cis- and trans-1,3-disubstituted housanes can be considered as flattened analogues of the corresponding cyclopentane derivatives with fixed envelope conformation of the five-membered ring.

HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS

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Page/Page column 96; 97, (2019/01/17)

Provided herein are compounds useful for the treatment of HBV infection in a subject in need thereof, pharmaceutical compositions thereof, and methods of inhibiting, suppressing, or preventing HBV infection in the subject.

COMPOSITIONS AND METHODS FOR TREATING AND PREVENTING NEURODEGENERATIVE DISORDERS

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Page/Page column 115; 116; 117, (2017/03/08)

Compounds, pharmaceutical compositions, methods and kits are described for treating or preventing neurodegenerative diseases such as Alzheimer's disease.

NOVEL CYCLOPENTANE DERIVATIVES

-

Page/Page column 58, (2010/12/29)

The invention relates to a compound of formula (I) wherein A1 and R1 to R5 are defined as in the description and in the claims. The compound of formula (I) can be used as a medicament.

Discovery of a potent and orally bioavailable CCR2 and CCR5 dual antagonist

Pasternak, Alexander,Goble, Stephen D.,Struthers, Mary,Vicario, Pasquale P.,Ayala, Julia M.,Di Salvo, Jerry,Kilburn, Ruth,Wisniewski, Thomas,Demartino, Julie A.,Mills, Sander G.,Yang, Lihu

scheme or table, p. 14 - 18 (2010/11/04)

This report describes the discovery of a potent, orally bioavailable CC chemokine receptor 2 (CCR2) antagonist which, while optimized for CCR2 potency, also had potent CC chemokine receptor 5 (CCR5) activity.

Heterocyclic cyclopentyl tetrahydroisoquinoline and tetrahydropyridopyridine modulators of chemokine receptor activity

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Page/Page column 28, (2008/06/13)

The present invention is directed to compounds of the formula I: Wherein R1, R2, R3, R4, R5, R6, R7, R8, R9, X, n and the broken lines are as defined herein which are useful as modulators of chemokine receptor activity. In particular, these compounds are useful as modulators of the chemokine receptor CCR-2.

AMINOCYCLOPENTYL PYRIDOPYRAZINONE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY

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Page/Page column 37, (2010/11/27)

Compounds of Formula I and Formula II (wherein A, E, j, k, m, n, R1, R2, R3, R4, R5, R6, R7, R8, R9, R10, R15, R16, R17, R18, R19, R24, R25, R26, R27, R28, R29, R30, R31, R32, R33, R34, X, Y and Z are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

2,6-Disubstituted piperiddines as modulators

-

Page/Page column 18, (2010/11/28)

The present invention is further directed to compounds of formula (I): wherein R1, R2, R3, R4, R5, R6, R7, R8, R9, R10, R16, R17, R18, R19, R20, R21 and R22 are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

BENZOXAZINYL-AMIDOCYCLOPENTYL-HETEROCYCLIC MODULATORS OF CHEMOKINE RECEPTORS

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Page/Page column 25-26, (2010/11/28)

Cyclopentyl compounds linked to a benzoxazinyl group through an amido moiety utilizing the ring nitrogen of the benzoxazine, and further substituted with a heterocyclic moiety, such compounds represented by formula I: which are used to modulate the CCR-2 chemokine receptor to prevent or treat inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis; and pharmaceutical compositions comprising these compounds and the use of these compounds and compositions.

TETRAHYDROPYRAN HETEROCYCLIC CYCLOPENTYL HETEROARYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY

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Page 63, (2008/06/13)

The present invention is further directed to compounds of the formulas: (I) (II) (wherein R1, R2, R3, R4, R5, R6, R7, R8, R9, R10, R15, R16, R17, R18, R19, R24 and R25 are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.

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