1-Methylpyrrolidine - ≥98% , CAS No.120-94-5

CAS: 120-94-5 Cat. No.: M109523 Formula: C₅H₁₁N Peso molecolare: 85.15 Beilstein Registry Number: 102445 Numero EC: 204-438-5

GRADE & PURITY ≥98%

Synonyms

CAS-120-94-5 | NCGC00255880-01 | EC 204-438-5 | N-methyl pyrollidine | FT-0608097 | W-108468 | M0415 | N-methylpyrrolidin | DTXSID8042210 | NSC 65579 | N-Methyltetrahydropyrrole | AKOS015850845 | InChI=1/C5H11N/c1-6-4-2-3-5-6/h2-5H2,1H | 06509TZU6C | UNII

Storage

Argon charged,Room temperature

Shipped In

Normal

Panoramica

1-Methylpyrrolidine is extensively used in the synthesis of pyrrolidine based ionic liquids.

Some of the other reported applications include:

• Synthesis of ionic liquid electrolytes for primary Li/CFx batteries.

• Preparation of ionic liquid as a reaction medium to carry out sulfuric acid-catalyzed conversion of alkynes to ketones.

• MCM-47, a highly crystalline ferrierite layered silicate, can be synthesized using a diquaternary ammonium salt prepared from the reaction of 1-methylpyrrolidine with 1,4-dibromobutane.

Specifications

Sinonimi

CAS-120-94-5 | NCGC00255880-01 | EC 204-438-5 | N-methyl pyrollidine | FT-0608097 | W-108468 | M0415 | N-methylpyrrolidin | DTXSID8042210 | NSC 65579 | N-Methyltetrahydropyrrole | AKOS015850845 | InChI=1/C5H11N/c1-6-4-2-3-5-6/h2-5H2,1H | 06509TZU6C | UNII

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

504751683

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751683

Sorrisi canonici

CN1CCCC1

IUPAC Name

1-methylpyrrolidine

InChIKey

AVFZOVWCLRSYKC-UHFFFAOYSA-N

INCHI

1S/C5H11N/c1-6-4-2-3-5-6/h2-5H2,1H3

Isomeri SMILES

CN1CCCC1

WGK Germania

3

RTECS

UY1420500

Numero UN

2924

Peso molecolare

85.15

Beilstein

102445

Reaxy-Rn

102445

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=102445&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrrolidines
      • Subclass N-alkylpyrrolidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolidines
• Subclass: N-alkylpyrrolidines
• Intermediate Tree Nodes: Not available
• Direct Parent: N-alkylpyrrolidines
• Alternative Parents: Trialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: N-alkylpyrrolidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as n-alkylpyrrolidines. These are compounds containing a pyrrolidine moiety that is substituted at the N1-position with an alkyl group. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Miscible with water.
• Sensibilità: Air Sensitive
• Indice di rifrazione: 1.4237-1.4257
• Punto di infiammabilità (°F): 1.4 °F
• Punto di infiammabilità (°C): -21℃
• Punto di ebollizione (°C): 80-81°C
• Punto di fusione (°C): -90°C
• Peso molecolare: 85.150 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 85.0891 Da
• Monoisotopic Mass: 85.0891 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 37.200
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Domande frequenti

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.