1H-pyrrolo[2,3-b]pyrazine - ≥97% , CAS No.42430-74-0

CAS: 42430-74-0 Cat. No.: D184472 Fórmula: C₆H₅N₃ Peso molecular: 119.12

GRADE & PURITY ≥97%

Synonyms

AKOS006326432 | FT-0647134 | A7270 | 4,7-DIAZAINDOLE | BB 0260578 | Pyrrolo(2,3-b)pyrazine | SY023099 | 5H-Pyrrolo[2,3-b]pyrazine # | 2-Ethoxy-N-methyl-N-[2-(methylphenethylamino)ethyl]-2,2-diphenylacetamide monohydrochloride | SCHEMBL17199 | 5H-Pyrrolo[2

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

AKOS006326432 | FT-0647134 | A7270 | 4,7-DIAZAINDOLE | BB 0260578 | Pyrrolo(2,3-b)pyrazine | SY023099 | 5H-Pyrrolo[2,3-b]pyrazine # | 2-Ethoxy-N-methyl-N-[2-(methylphenethylamino)ethyl]-2,2-diphenylacetamide monohydrochloride | SCHEMBL17199 | 5H-Pyrrolo[2

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: C1=CNC2=NC=CN=C21
• IUPAC Name: 5H-pyrrolo[2,3-b]pyrazine
• InChIKey: HFTVJMFWJUFBNO-UHFFFAOYSA-N
• INCHI: 1S/C6H5N3/c1-2-8-6-5(1)7-3-4-9-6/h1-4H,(H,8,9)
• Isómeros SMILES: C1=CNC2=NC=CN=C21
• Peso molecular: 119.12
• Reaxy-Rn: 606572
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606572&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyrrolopyrazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyrrolopyrazines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolopyrazines
• Alternative Parents: Pyrazines Pyrroles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolopyrazine - Pyrazine - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrrolopyrazines. These are compounds containing a pyrrolopyrazine moiety, which consists of a pyrrole ring fused to a pyrazine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazine is a 6-membered ring consisting of six carbon atoms and two nitrogen centers at ring positions 1 and 4.
• 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: Moisture sensitive
• Peso molecular: 119.120 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 119.048 Da
• Monoisotopic Mass: 119.048 Da
• Topological Polar Surface Area: 41.600 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 104.000
• 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?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 42430-74-0, the molecular formula is C6H5N3, and the molecular weight is 119.12 g/mol. InChIKey HFTVJMFWJUFBNO-UHFFFAOYSA-N.

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.