3-Bromo-4-methoxypyridine - ≥98% , CAS No.82257-09-8

CAS: 82257-09-8 Cat. No.: B195182 Peso molecular: 188.02 Número EC: 826-823-2

GRADE & PURITY ≥98%

Synonyms

AM20061525 | 3-bromo-4-methoxy-pyridine, AldrichCPR | A850433 | EN300-90214 | AB22230 | FS-3508 | DTXSID10349078 | AKOS006293960 | 3-bromo-4-methoxypyridine | 3-Bromo-4-methoxy-pyridine | pyridine, 3-bromo-4-methoxy- | SY039028 | InChI=1/C6H6BrNO/c1-9-6-2

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

AM20061525 | 3-bromo-4-methoxy-pyridine, AldrichCPR | A850433 | EN300-90214 | AB22230 | FS-3508 | DTXSID10349078 | AKOS006293960 | 3-bromo-4-methoxypyridine | 3-Bromo-4-methoxy-pyridine | pyridine, 3-bromo-4-methoxy- | SY039028 | InChI=1/C6H6BrNO/c1-9-6-2

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C

Enviado en

Ice chest + Ice pads

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

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: COC1=C(C=NC=C1)Br
• IUPAC Name: 3-bromo-4-methoxypyridine
• InChIKey: DSFJKFHIMBVWAV-UHFFFAOYSA-N
• INCHI: 1S/C6H6BrNO/c1-9-6-2-3-8-4-5(6)7/h2-4H,1H3
• Isómeros SMILES: COC1=C(C=NC=C1)Br
• Peso molecular: 188.02
• Reaxy-Rn: 1423610
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1423610&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Pyridines and derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
• 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

• Solubilidad: Slightly soluble in water (9.8 g/L).
• Sensibilidad: Light sensitive
• Peso molecular: 188.020 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 186.963 Da
• Monoisotopic Mass: 186.963 Da
• Topological Polar Surface Area: 22.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 89.100
• 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