2-Bromoquinoxaline - ≥97% , CAS No.36856-91-4

CAS: 36856-91-4 Cat. No.: B123033 Formula: C₈H₅BrN₂ Peso molecolare: 209.04 Numero EC: 692-642-9

GRADE & PURITY ≥97%

Synonyms

2-Bromoquinoxaline | 2-Bromo-quinoxaline | BROMOQUINOXALINE | SCHEMBL197269 | 10.14272/XVKLMYQMVPHUPN-UHFFFAOYSA-N.3 | AM20070347 | DTXSID30342465 | 10.14272/XVKLMYQMVPHUPN-UHFFFAOYSA-N.1 | AC-28077 | SY021711 | EN300-78716 | F1770-0056 | MFCD07368206 | J

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinonimi

2-Bromoquinoxaline | 2-Bromo-quinoxaline | BROMOQUINOXALINE | SCHEMBL197269 | 10.14272/XVKLMYQMVPHUPN-UHFFFAOYSA-N.3 | AM20070347 | DTXSID30342465 | 10.14272/XVKLMYQMVPHUPN-UHFFFAOYSA-N.1 | AC-28077 | SY021711 | EN300-78716 | F1770-0056 | MFCD07368206 | J

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice

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

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

504759358

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759358

Sorrisi canonici

C1=CC=C2C(=C1)N=CC(=N2)Br

IUPAC Name

2-bromoquinoxaline

InChIKey

XVKLMYQMVPHUPN-UHFFFAOYSA-N

INCHI

1S/C8H5BrN2/c9-8-5-10-6-3-1-2-4-7(6)11-8/h1-5H

Isomeri SMILES

C1=CC=C2C(=C1)N=CC(=N2)Br

WGK Germania

3

Peso molecolare

209.04

Reaxy-Rn

956833

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=956833&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazanaphthalenes
      • Subclass Benzodiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinoxalines
• Alternative Parents: Pyrazines Benzenoids Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinoxaline - Benzenoid - Pyrazine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
• 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

• Punto di fusione (°C): 56-60°C
• Peso molecolare: 209.040 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 207.964 Da
• Monoisotopic Mass: 207.964 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 140.000
• 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

Domande frequenti

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 36856-91-4, the molecular formula is C8H5BrN2, and the molecular weight is 209.04 g/mol. InChIKey XVKLMYQMVPHUPN-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.