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313950-41-3

1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE is a chemical compound characterized by the molecular formula C14H27NO2. It is a derivative of piperidine, featuring a BOC (tert-butoxycarbonyl) protecting group at the nitrogen atom. 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE is recognized for its versatility in organic synthesis and pharmaceutical research, serving as a valuable building block for the development of pharmaceutical drugs and as a reagent in various organic chemistry reactions.

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  • 313950-41-3 Structure

  • Basic information

    1. Product Name: 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE
    2. Synonyms: 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE;2-ISOPROPYL-4-OXOPIPERIDINE, N-BOC PROTECTED;TERT-BUTYL 2-ISOPROPYL-4-OXOPIPERIDINE-1-CARBOXYLATE;2-Isopropyl-4-oxopiperidine, N-BOC protected 97%;1-N-Boc-2-Isopropylpiperidin-4-one;1-Piperidinecarboxylic acid, 2-(1-Methylethyl)-4-oxo-, 1,1-diMethylethyl ester;2-Isopropylpiperidin-4-one, N-BOC protected 97%;tert-Butyl 2-isopropyl-4-oxopiperidine-1-carboxylate, tert-Butyl 4-oxo-2-(prop-2-yl)piperidine-1-carboxylate
    3. CAS NO:313950-41-3
    4. Molecular Formula: C13H23NO3
    5. Molecular Weight: 241.33
    6. EINECS: N/A
    7. Product Categories: Pyrans, Piperidines &Piperazines;Pyrans, Piperidines & Piperazines
    8. Mol File: 313950-41-3.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 325.7 °C at 760 mmHg
    3. Flash Point: 150.8 °C
    4. Appearance: /
    5. Density: 1.034 g/cm3
    6. Vapor Pressure: 0.000226mmHg at 25°C
    7. Refractive Index: 1.472
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. CAS DataBase Reference: 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE(313950-41-3)
    12. EPA Substance Registry System: 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE(313950-41-3)

  • 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: 313950-41-3(Hazardous Substances Data)

313950-41-3 Usage

Uses

Used in Pharmaceutical Research and Development:
1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE is used as a building block for the synthesis of pharmaceutical drugs due to its potential to be modified and incorporated into different molecular scaffolds. Its unique properties make it a promising candidate for drug discovery, contributing to the creation of novel therapeutic agents.
Used in Organic Chemistry Reactions:
In the realm of organic chemistry, 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE is utilized as a reagent, facilitating various chemical reactions. Its presence can influence the course of reactions, enabling the synthesis of complex organic molecules and aiding in the advancement of chemical research.
Used in Drug Discovery:
1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE is employed as a valuable tool in drug discovery processes. Its ability to be modified and integrated into molecular scaffolds allows researchers to explore new avenues for the development of effective pharmaceuticals, potentially leading to breakthroughs in the treatment of various diseases and conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 313950-41-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,1,3,9,5 and 0 respectively; the second part has 2 digits, 4 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 313950-41:
(8*3)+(7*1)+(6*3)+(5*9)+(4*5)+(3*0)+(2*4)+(1*1)=123
123 % 10 = 3
So 313950-41-3 is a valid CAS Registry Number.
InChI:InChI=1/C13H23NO3/c1-9(2)11-8-10(15)6-7-14(11)12(16)17-13(3,4)5/h9,11H,6-8H2,1-5H3

313950-41-3SDS

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 tert-butyl 4-oxo-2-propan-2-ylpiperidine-1-carboxylate

1.2 Other means of identification

Product number -
Other names tert-Butyl 2-isopropyl-4-oxopiperidine-1-carboxylate

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:313950-41-3 SDS

313950-41-3Relevant articles and documents

A diastereoselective synthesis of 2,4-disubstituted piperidines: scaffolds for drug discovery.

Watson,Jiang,Scott

, p. 3679 - 3681 (2007/10/03)

A method for the diastereoselective synthesis of 2,4-disubstituted piperidines has been developed which enables the complete control of reaction selectivity merely by changing the order of the reaction sequence. These targets provide convenient platforms

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