2-chloro-5H-pyrrolo[2,3-b]pyrazine - ≥97% , CAS No.889447-19-2

CAS: 889447-19-2 Cat. No.: C634974 Peso molecular: 153.57 Número EC: 190-886-6 PubChem CID: 45789638

GRADE & PURITY ≥97%

Synonyms

AKOS006323664 | FT-0650335 | DTXSID40671915 | 2-chloro-5H-pyrrolo[2 pound not3-b]pyrazine | PB23882 | RORAIVYFQFAIAF-UHFFFAOYSA-N | EN300-108270 | A843006 | SCHEMBL650714 | 2-chloranyl-5H-pyrrolo[2,3-b]pyrazine | AMY23488 | J-508838 | SY006885 | MFCD11518

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

AKOS006323664 | FT-0650335 | DTXSID40671915 | 2-chloro-5H-pyrrolo[2 pound not3-b]pyrazine | PB23882 | RORAIVYFQFAIAF-UHFFFAOYSA-N | EN300-108270 | A843006 | SCHEMBL650714 | 2-chloranyl-5H-pyrrolo[2, 3-b]pyrazine | AMY23488 | J-508838 | SY006885 | MFCD11518

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=C(N=C21)Cl
• IUPAC Name: 2-chloro-5H-pyrrolo[2,3-b]pyrazine
• InChIKey: RORAIVYFQFAIAF-UHFFFAOYSA-N
• INCHI: 1S/C6H4ClN3/c7-5-3-9-6-4(10-5)1-2-8-6/h1-3H,(H,8,9)
• Isómeros SMILES: C1=CNC2=NC=C(N=C21)Cl
• CAS alternativo: 889447-19-2
• PubChem CID: 45789638
• Peso molecular: 153.57

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 Aryl chlorides Pyrroles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolopyrazine - Pyrazine - Aryl halide - Aryl chloride - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen 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

Propiedades químicas y físicas

• Peso molecular: 153.570 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 153.009 Da
• Monoisotopic Mass: 153.009 Da
• Topological Polar Surface Area: 41.600 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 130.000
• 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