313950-41-3

Basic information

• Product Name: 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE
• 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
• CAS NO: 313950-41-3
• Molecular Formula: C₁₃H₂₃NO₃
• Molecular Weight: 241.33
• Product Categories: Pyrans, Piperidines &Piperazines;Pyrans, Piperidines & Piperazines
• Mol File: 313950-41-3.mol
• Article Data: 2

Chemical Properties

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

Safety Data

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

Usage

General Description

1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE is a chemical compound with the molecular formula C14H27NO2. It is a derivative of piperidine and contains a BOC (tert-butoxycarbonyl) protecting group at the nitrogen atom. This chemical is commonly used as a building block in organic synthesis and pharmaceutical research. It has potential applications in the development of pharmaceutical drugs and as a reagent in organic chemistry reactions. 1-BOC-2-ISOPROPYL-PIPERIDIN-4-ONE has properties that make it suitable for modification and incorporation into various molecular scaffolds, making it a valuable tool in drug discovery and chemical synthesis.

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

Upstream product

• 313950-38-8 2-isopropyl-4-oxo-3,4-dihydro-2H-pyridine-1-carboxylic acid phenyl ester 
• 201667-15-4 2-isopropyl-2,3-dihydropyridin-4(1H)-one 
• 24424-99-5 di-tert-butyl dicarbonate 
• 620-08-6 4-methoxypyridine 
• 313950-39-9 2-isopropyl-4-oxo-3,4-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester 

Downstream Products

• 313950-42-4 2-Isopropyl-4-[1-phenyl-meth-(E)-ylidene]-piperidine-1-carboxylic acid tert-butyl ester 
• 313950-60-6 2-((2R,4R)-2-Isopropyl-piperidin-4-yl)-ethanol 
• 313950-60-6 2-((2R,4S)-2-Isopropyl-piperidin-4-yl)-ethanol 

Relevant articles and documents

COMPOUND

There is provided a compound having Formula (I) wherein each of R1, R2, R4, R5, R6 and R7 are independently selected from (a) H, (b) R17, -OC(R17)3, -OCH(R17)2, -(OCH2R)17, -C(R17)3, -CH(R17)2, or -CH2R17 wherein R17 is a halogen; (c) -CN; (d) optionally substituted alkyl, (e) optionally substituted heteroalkyl; (f) optionally substituted aryl; (g) optionally substituted heteroaryl; (h) optionally substituted arylalkyl; (i) optionally substituted heteroarylalkyl; (j) hydroxy; (k) alkoxy; (l) aryloxy; (m) -SO2-alkyl; and (n) -N(R11)C(O)R13; wherein the optional substituents of (d) (e) (f) (h) and (i) are selected from the group consisting of: C1-6 alkyl, halo, cyano, nitro, haloalkyl, hydroxy, alkoxy, carboxy, carboxyalkyl, carboxamide, mercapto, amino, alkylamino, dialkylamino, sulfonyl, sulfonamido, aryl and heteroaryl ; each of rings A and B are selected from five or six membered carbon rings optionally containing one or more hetero atoms selected from N, S, and O and optionally having fused thereto a further ring; X is an optional group selected from O, S, S=O, S(=O)2, C=O, S(=O)2NR8, C=ONR9, NR10, wherein R8, R9 and R10 are independently selected from H and hydrocarbyl, wherein n and p are independently selected from O and 1 ; Y is (R11)1-3 wherein each R11 is independently selected from NR12, CR13R14, S(=O)2 and C=O, wherein R12, R13 and R14 are independently selected from H and hydrocarbyl; Z is selected from (i) six or seven membered ring containing carbon and at least one nitrogen, which may be optionally substituted wherein the substituents may together form further ring fused thereto; and (ii) a -R15-NR16- group wherein R15 is an optionally substituted C1-6 alkyl chain and R16 is selected from H and hydrocarbyl; and R3 is selected from Formula (A).