132945-78-9

Basic information

• Product Name: (S)-1-BOC-3-Cyanopyrrolidine
• Synonyms: (S)-1-N-(tert-Butoxycarbonyl)-3-cyanopyrrolidine;(S)-1-N-BOC-3-CYANO-PYRROLIDINE;(S)-3-CYANO-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;(S)-1-BOC-3-Cyanopyrrolidine;(S)-TERT-BUTYL-3-CYANOPYRROLIDINE-1-CARBOXYLATE;N-T-BOC-3(S)-CYANOPYRROLIDINE;(S)-1-Boc-3-cyanopyrrolid...;tert-butyl (3S)-3-cyanopyrrolidine-1-carboxylate
• CAS NO: 132945-78-9
• Molecular Formula: C₁₀H₁₆N₂O₂
• Molecular Weight: 196.25
• Product Categories: Pyrrole&Pyrrolidine&Pyrroline
• Mol File: 132945-78-9.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 307.9 °C at 760 mmHg
• Flash Point: 140 °C
• Appearance: /
• Density: 1.08 g/cm³
• Vapor Pressure: 0.000703mmHg at 25°C
• Refractive Index: 1.488
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: -3.73±0.40(Predicted)
• CAS DataBase Reference: (S)-1-BOC-3-Cyanopyrrolidine(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-1-BOC-3-Cyanopyrrolidine(132945-78-9)
• EPA Substance Registry System: (S)-1-BOC-3-Cyanopyrrolidine(132945-78-9)

Safety Data

• Hazard Codes: Xn
• Statements: 36/37/38
• Safety Statements: 26-36
• WGK Germany: 3
• Hazardous Substances Data: 132945-78-9(Hazardous Substances Data)

Usage

General Description

(S)-1-BOC-3-Cyanopyrrolidine is a chemical compound with the molecular formula C11H17NO2 that is used in the synthesis of various organic compounds. It is a derivative of pyrrolidine and contains a BOC (tert-butyloxycarbonyl) protecting group, which makes it useful in organic synthesis as a building block for more complex molecules. (S)-1-BOC-3-Cyanopyrrolidine is typically used as a reagent in the production of pharmaceuticals and other fine chemicals. The cyanopyrrolidine group in the molecule provides a reactive site for further chemical modification, making it a versatile intermediate in organic chemistry. The compound is important in the field of medicinal chemistry and drug discovery for its role in the synthesis of potential pharmaceutical compounds.

InChI:InChI=1/C10H16N2O2/c1-10(2,3)14-9(13)12-5-4-8(6-11)7-12/h8H,4-5,7H2,1-3H3/t8-/m1/s1

Upstream product

• 73286-70-1 N-(tert-butoxycarbonyl)-3-pyrroline 
• 773837-37-9 sodium cyanide 
• 127423-61-4 tert-butyl (3R)-3-methylsulfonyloxypyrrolidine-1-carboxylate 
• 109431-87-0 (R)-tert-butyl 3-hydroxypyrrolidine-1-carboxylate 

Downstream Products

• 199174-29-3 tert-butyl (R)-3-(aminomethyl)pyrrolidine-1-carboxylate 
• 140148-70-5 (S)-1-N-boc-β-proline 
• 1352661-27-8 C₁₉H₂₅N₅O₇ 

Relevant articles and documents

Novel pyrrolidine or piperidine derivatives having activity for T-type calcium channel

A pyrrolidine or piperidine compound having activity for T - type calcium channel, wherein the pyrrolidine or piperidine compound of Formula 1 according to the present invention has an excellent antagonistic activity to, T-type calcium channel, and can be used as a preventive or therapeutic agent, for pain diseases, or cancer related to cancer, or cancer such as, epilepsy and,hepatic pain, angina. (by machine translation)

Synthesis and biological evaluation of pyrrolidine-based T-type calcium channel inhibitors for the treatment of neuropathic pain

The treatment of neuropathic pain is one of the urgent unmet medical needs and T-type calcium channels are promising therapeutic targets for neuropathic pain. Several potent T-type channel inhibitors showed promising in vivo efficacy in neuropathic pain a

CARBAPENEM ANTIBACTERIALS WITH GRAM-NEGATIVE ACTIVITY

The present invention provides β-methyl carbapenem compounds and pharmaceutical compositions useful in the treatment of bacterial infections and methods for treating such infections using such compounds and/or compositions. The invention includes administering an effective amount of a carbapenem compound or salt and/or prodrug thereof to a host in need of such a treatment.