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Tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate is a chemical compound that serves as a versatile intermediate in the synthesis of pharmaceuticals. It is a derivative of piperidine, featuring a tert-butyl group, a 2-(2-chloroethyl) group, and a 2-cyanopiperidine-1-carboxylate group. The combination of these functional groups endows it with unique properties and reactivity, making it a promising building block for the development of more complex pharmaceutical compounds.

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  • 960294-15-9 Structure
  • Basic information

    1. Product Name: tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate
    2. Synonyms: tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate;2-(2-Chloroethyl)-2-cyano-1-piperidinecarboxylic acid tert-butyl ester;1-Piperidinecarboxylic acid, 2-(2-chloroethyl)-2-cyano-, 1,1-diMethylethyl ester;2-Methyl-2-propanyl 2-(2-chloroethyl)-2-cyano-1-piperidinecarboxylate
    3. CAS NO:960294-15-9
    4. Molecular Formula: C13H21ClN2O2
    5. Molecular Weight: 273
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 960294-15-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.13
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate(CAS DataBase Reference)
    10. NIST Chemistry Reference: tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate(960294-15-9)
    11. EPA Substance Registry System: tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate(960294-15-9)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 960294-15-9(Hazardous Substances Data)

960294-15-9 Usage

Uses

Used in Pharmaceutical Synthesis:
Tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate is used as a key intermediate in the synthesis of various pharmaceutical compounds. Its unique structure and reactivity allow for the creation of complex molecules with potential therapeutic applications.
Used in Organic Synthesis:
In the field of organic synthesis, tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate is utilized as a versatile building block. Its presence of the tert-butyl and chloroethyl groups makes it a potentially reactive component in the formation of new organic compounds, contributing to the advancement of chemical research and development.
Used in Drug Development:
Tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate is employed in drug development as a precursor for the creation of novel pharmaceutical agents. Its specific properties and reactivity enable the design and synthesis of new drugs with improved efficacy and selectivity, addressing unmet medical needs.
Used in Medicinal Chemistry Research:
In the realm of medicinal chemistry, tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate is used as a valuable tool for exploring the structure-activity relationships of potential drug candidates. Its unique functional groups facilitate the investigation of molecular interactions and the optimization of drug-like properties.
Overall, tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate is a multifaceted chemical compound with a wide range of applications in the pharmaceutical and chemical industries, playing a crucial role in the development of innovative therapeutic agents and the advancement of organic synthesis techniques.

Check Digit Verification of cas no

The CAS Registry Mumber 960294-15-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 9,6,0,2,9 and 4 respectively; the second part has 2 digits, 1 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 960294-15:
(8*9)+(7*6)+(6*0)+(5*2)+(4*9)+(3*4)+(2*1)+(1*5)=179
179 % 10 = 9
So 960294-15-9 is a valid CAS Registry Number.

960294-15-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl 2-(2-chloroethyl)-2-cyanopiperidine-1-carboxylate

1.2 Other means of identification

Product number -
Other names -

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 -
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More Details:960294-15-9 SDS

960294-15-9Relevant articles and documents

Practical synthesis of structurally important spirodiamine templates

Tang,Qu,Xu,Ma,Chen, Shu-Hui,Li

, p. 3793 - 3799 (2008/02/10)

A general, concise, four-step synthetic sequence for the preparation of spirodiamine templates is described herein. Copyright Taylor & Francis Group, LLC.

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