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(S)-1-BOC-3-ACETAMIDOPYRROLIDINE, also known as (S)-tert-butoxycarbonyl-3-acetamidopyrrolidine, is a chiral chemical compound that serves as a crucial intermediate in the synthesis of pharmaceuticals and other organic compounds. Characterized by a pyrrolidine ring and a tert-butoxycarbonyl (BOC) protecting group on the nitrogen atom, this compound leverages the BOC group to manage its reactivity and stereochemistry during organic synthesis. Its unique structure and reactivity render it an indispensable tool in the creation of various chiral compounds and drug synthesis.

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  • 1-Pyrrolidinecarboxylicacid, 3-(acetylamino)-, 1,1-dimethylethyl ester, (3S)-

    Cas No: 114636-37-2

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  • 114636-37-2 Structure
  • Basic information

    1. Product Name: (S)-1-BOC-3-ACETAMIDOPYRROLIDINE
    2. Synonyms: (S)-(-)-1-BOC-3-ACETAMIDOPYRROLIDINE;(S)-1-BOC-3-ACETYLAMINO PYRROLIDINE;TERT-BUTYL (3S)-3-(ACETYLAMINO)-1-PYRROLIDINECARBOXYLATE;(S)-tert-Butyl 3-acetaMidopyrrolidine-1-carboxylate;tert-Butyl (S)-3-acetamidopyrrolidine-1-carboxylate;tert-butyl (3s)-3-acetamidopyrrolidine-1-carboxylate;(S)-N-Boc-3-acetamidopyrrolidine;(S)-N-Boc-3-acetamidopyrrolidine,99%e.e.
    3. CAS NO:114636-37-2
    4. Molecular Formula: C11H20N2O3
    5. Molecular Weight: 228.2881
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 114636-37-2.mol
  • Chemical Properties

    1. Melting Point: 86-90 °C
    2. Boiling Point: 381.3 °Cat 760 mmHg
    3. Flash Point: 184.4 °C
    4. Appearance: /
    5. Density: 1.1 g/cm3
    6. Vapor Pressure: 5.11E-06mmHg at 25°C
    7. Refractive Index: 1.494
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. PKA: 15.83±0.20(Predicted)
    11. CAS DataBase Reference: (S)-1-BOC-3-ACETAMIDOPYRROLIDINE(CAS DataBase Reference)
    12. NIST Chemistry Reference: (S)-1-BOC-3-ACETAMIDOPYRROLIDINE(114636-37-2)
    13. EPA Substance Registry System: (S)-1-BOC-3-ACETAMIDOPYRROLIDINE(114636-37-2)
  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 22-36/37/38
    3. Safety Statements: 26
    4. WGK Germany: 2
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 114636-37-2(Hazardous Substances Data)

114636-37-2 Usage

Uses

Used in Pharmaceutical Industry:
(S)-1-BOC-3-ACETAMIDOPYRROLIDINE is used as a key intermediate for the synthesis of a variety of drugs. Its role is pivotal in the development of new pharmaceuticals, contributing to the advancement of medicinal chemistry.
Used as a Building Block in Organic Synthesis:
In the realm of organic synthesis, (S)-1-BOC-3-ACETAMIDOPYRROLIDINE is utilized as a building block for the creation of other chiral compounds. Its presence facilitates the construction of complex molecular structures with specific stereochemistry, which is essential for the biological activity and selectivity of the resulting compounds.
Used in the Control of Reactivity and Stereochemistry:
The BOC protecting group in (S)-1-BOC-3-ACETAMIDOPYRROLIDINE is used to control the reactivity of the nitrogen atom during synthesis processes. This control is vital for maintaining the desired stereochemistry of the final product, ensuring the compound's efficacy and selectivity in biological systems.

Check Digit Verification of cas no

The CAS Registry Mumber 114636-37-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,4,6,3 and 6 respectively; the second part has 2 digits, 3 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 114636-37:
(8*1)+(7*1)+(6*4)+(5*6)+(4*3)+(3*6)+(2*3)+(1*7)=112
112 % 10 = 2
So 114636-37-2 is a valid CAS Registry Number.
InChI:InChI=1/C11H20N2O3/c1-8(14)12-9-5-6-13(7-9)10(15)16-11(2,3)4/h9H,5-7H2,1-4H3,(H,12,14)/t9-/m0/s1

114636-37-2 Well-known Company Product Price

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  • Aldrich

  • (665088)  (S)-(−)-1-Boc-3-acetamidopyrrolidine  97%

  • 114636-37-2

  • 665088-1G

  • 1,239.03CNY

  • Detail
  • Aldrich

  • (665088)  (S)-(−)-1-Boc-3-acetamidopyrrolidine  97%

  • 114636-37-2

  • 665088-5G

  • 4,650.75CNY

  • Detail

114636-37-2SDS

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 (3S)-3-acetamidopyrrolidine-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

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More Details:114636-37-2 SDS

114636-37-2Relevant articles and documents

PYRAZOLOPYRIMIDINES HAVING ACTIVITY AGAINST THE RESPIRATORY SYNCYTIAL VIRUS (RSV)

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Page/Page column 31; 32, (2019/06/17)

The invention concerns compounds having antiviral activity, in particular, having an inhibitory activity on the replication of the respiratory syncytial virus (RSV). The invention further concerns pharmaceutical compositions comprising these compounds and

CARBAPENEM ANTIBACTERIALS WITH GRAM-NEGATIVE ACTIVITY

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Page/Page column 68, (2012/01/06)

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.

NOVEL COMPOUNDS

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Page/Page column 33, (2008/06/13)

A compound of Formula (I) and pharmaceutically and/or veterinarily acceptable derivatives thereof, wherein: R1 is H, C1-6alkyl, - C(A)D, C3-8cycloalkyl, aryl, het, aryl-C1-4alkyl or het-C1-4/sub

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