7-Bromopyrazolo[1,5-a]pyridine - ≥96% , CAS No.885275-75-2

CAS: 885275-75-2 Cat. No.: B590529 Formula: C₇H₅N₂Br Peso molecolare: 197.03 Numero EC: 878-971-2

GRADE & PURITY ≥96%

Synonyms

1-(tert-Butyl)2-methyl4-bromo-1H-pyrrole-1,2-dicarboxylate | 7-BROMO-PYRAZOLO[1,5-A]PYRIDINE | 7-bromopyrazolo[1,5-a]pyridine | AB28896 | SY289214 | F53404 | AMY30457 | DTXSID10648235 | SCHEMBL2715907 | AKOS006292095 | FT-0648751 | MFCD06739220 | A861986

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Specifications

Sinonimi

1-(tert-Butyl)2-methyl4-bromo-1H-pyrrole-1,2-dicarboxylate | 7-BROMO-PYRAZOLO[1,5-A]PYRIDINE | 7-bromopyrazolo[1,5-a]pyridine | AB28896 | SY289214 | F53404 | AMY30457 | DTXSID10648235 | SCHEMBL2715907 | AKOS006292095 | FT-0648751 | MFCD06739220 | A861986

Specifiche e purezza

≥96%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Desiccated

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥96%

Nomi e identificatori

Pubchem Sid

508810238

Sorrisi canonici

C1=CC2=CC=NN2C(=C1)Br

IUPAC Name

7-bromopyrazolo[1,5-a]pyridine

InChIKey

XVUCNKOQDLZUQY-UHFFFAOYSA-N

INCHI

1S/C7H5BrN2/c8-7-3-1-2-6-4-5-9-10(6)7/h1-5H

Isomeri SMILES

C1=CC2=CC=NN2C(=C1)Br

CAS alternativo

885275-75-2

Peso molecolare

197.03

Reaxy-Rn

32879474

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=32879474&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrazolopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrazolopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrazolopyridines
• Alternative Parents: 2-halopyridines Aryl bromides Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrazolopyridine - 2-halopyridine - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as pyrazolopyridines. These are compounds containing a pyrazolopyridine skeleton, which consists of a pyrazole fused to a pyridine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Pyridine is a 6-membered ring with four carbon and one nitrogen 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

Proprietà chimiche e fisiche

• Peso molecolare: 197.030 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 195.964 Da
• Monoisotopic Mass: 195.964 Da
• Topological Polar Surface Area: 17.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 129.000
• 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