3-Methylpyrrole - ≥98%(GC) , CAS No.616-43-3

CAS: 616-43-3 Cat. No.: M139090 Fórmula: C₅H₇N Peso molecular: 81.12 Número EC: 633-085-3

GRADE & PURITY ≥98%(GC)

Synonyms

1H-Pyrrole, 3-methyl- | Z1203730789 | PS-17365 | BDBM50167953 | 3-Methyl pyrrole | AMY14173 | F8889-1676 | 5-METHYLPYRROLE | PB12076 | Q27455865 | A8540 | EN300-88674 | 1li6 | AKOS006223957 | PD060215 | Pyrrole, 3-methyl- | 3-Methyl-1H-pyrrole | FT-063013

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

1H-Pyrrole, 3-methyl- | Z1203730789 | PS-17365 | BDBM50167953 | 3-Methyl pyrrole | AMY14173 | F8889-1676 | 5-METHYLPYRROLE | PB12076 | Q27455865 | A8540 | EN300-88674 | 1li6 | AKOS006223957 | PD060215 | Pyrrole, 3-methyl- | 3-Methyl-1H-pyrrole | FT-063013

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Store at -20°C,Argon charged

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%(GC)

Nombres e identificadores

Pubchem Sid

504752245

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752245

Sonrisas canónicas

CC1=CNC=C1

IUPAC Name

3-methyl-1H-pyrrole

InChIKey

FEKWWZCCJDUWLY-UHFFFAOYSA-N

INCHI

1S/C5H7N/c1-5-2-3-6-4-5/h2-4,6H,1H3

Isómeros SMILES

CC1=CNC=C1

WGK Alemania

3

Peso molecular

81.12

Reaxy-Rn

104214

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=104214&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyrroles
      • Subclass Substituted pyrroles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyrroles
• Subclass: Substituted pyrroles
• Intermediate Tree Nodes: Not available
• Direct Parent: Substituted pyrroles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Substituted pyrrole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as substituted pyrroles. These are heterocyclic compounds containing a pyrrole ring substituted at one or more positions.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Air Sensitive
• Índice de refracción: 1.5
• Punto de inflamación (°C): 47 °C
• Punto de ebullición (°C): 144 °C
• Punto de fusión (°C): -48 °C
• Peso molecular: 81.120 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 81.0578 Da
• Monoisotopic Mass: 81.0578 Da
• Topological Polar Surface Area: 15.800 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 43.200
• 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

Preguntas frecuentes

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.