2-Methyl-1H-pyrrolo[3,2-b]pyridine - ≥97% , CAS No.73177-35-2

CAS: 73177-35-2 Cat. No.: M304502 Peso molecular: 132.166 Número EC: 894-523-9

GRADE & PURITY ≥97%

Synonyms

1H-Pyrrolo[3,2-b]pyridine, 2-methyl- | A837737 | DS-15620 | SCHEMBL4641753 | DTXSID00468964 | FT-0654297 | MFCD12923706 | 2-methyl-1H-pyrrolo[3,2-b]pyridine | AMY9415 | AKOS015998756 | 2-methyl-1H-pyrrolo[3,2-b]pyridin | 2-methyl-4-azaindole | FTDBLXOLABK

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinónimos

1H-Pyrrolo[3, 2-b]pyridine, 2-methyl- | A837737 | DS-15620 | SCHEMBL4641753 | DTXSID00468964 | FT-0654297 | MFCD12923706 | 2-methyl-1H-pyrrolo[3, 2-b]pyridine | AMY9415 | AKOS015998756 | 2-methyl-1H-pyrrolo[3, 2-b]pyridin | 2-methyl-4-azaindole | FTDBLXOLABK

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature, Desiccated

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504766565
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766565
• Sonrisas canónicas: CC1=CC2=C(N1)C=CC=N2
• IUPAC Name: 2-methyl-1H-pyrrolo[3,2-b]pyridine
• InChIKey: FTDBLXOLABKXNQ-UHFFFAOYSA-N
• INCHI: 1S/C8H8N2/c1-6-5-8-7(10-6)3-2-4-9-8/h2-5,10H,1H3
• Isómeros SMILES: CC1=CC2=C(N1)C=CC=N2
• Peso molecular: 132.166
• Reaxy-Rn: 112279
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=112279&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyrrolopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyrrolopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolopyridines
• Alternative Parents: Substituted pyrroles Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolopyridine - Substituted pyrrole - Pyridine - 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 pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
• 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

• Punto de inflamación (°C): 126.04°C
• Punto de ebullición (°C): 282.8°C at 760 mmHg
• Peso molecular: 132.160 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 132.069 Da
• Monoisotopic Mass: 132.069 Da
• Topological Polar Surface Area: 28.700 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 124.000
• 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