2-bromo-5-methoxy-pyridin-4-amine - ≥97% , CAS No.1417644-40-6

CAS: 1417644-40-6 Cat. No.: B629033 Peso molecular: 203.04 Número EC: 864-749-2 PubChem CID: 118851337

GRADE & PURITY ≥97%

Synonyms

AKOS027315789 | SY129404 | 2-Bromo-5-methoxypyridin-4-amine | MFCD26520651 | SB78596 | 4-Amino-2-bromo-5-methoxypyridine | 4-Pyridinamine, 2-bromo-5-methoxy- | A903753 | AC1554 | 2-Bromo-5-methoxypyridin-4-ylamine | 1417644-40-6 | AMY16335 | 2-Bromo-5-met

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AKOS027315789 | SY129404 | 2-Bromo-5-methoxypyridin-4-amine | MFCD26520651 | SB78596 | 4-Amino-2-bromo-5-methoxypyridine | 4-Pyridinamine, 2-bromo-5-methoxy- | A903753 | AC1554 | 2-Bromo-5-methoxypyridin-4-ylamine | 1417644-40-6 | AMY16335 | 2-Bromo-5-met

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: COC1=CN=C(C=C1N)Br
• IUPAC Name: 2-bromo-5-methoxypyridin-4-amine
• InChIKey: ZMXFLZUNHINXLA-UHFFFAOYSA-N
• INCHI: 1S/C6H7BrN2O/c1-10-5-3-9-6(7)2-4(5)8/h2-3H,1H3,(H2,8,9)
• Isómeros SMILES: COC1=CN=C(C=C1N)Br
• CAS alternativo: 1417644-40-6
• PubChem CID: 118851337
• Peso molecular: 203.04

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazines
      • Subclass Pyrimidines and pyrimidine derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazines
• Subclass: Pyrimidines and pyrimidine derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: O-alkylpyrimidines
• Alternative Parents: Polyhalopyridines Methylpyridines Alkyl aryl ethers 2-halopyridines Heteroaromatic compounds Imidoyl bromides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Organobromides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: O-alkylpyrimidine - Polyhalopyridine - 2-halopyridine - Methylpyridine - Alkyl aryl ether - Pyridine - Heteroaromatic compound - Imidoyl halide - Imidoyl bromide - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Primary aliphatic amine - Amine - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as o-alkylpyrimidines. These are compounds containing a pyrimidine , which is O-alkylated at one or more ring positions.
• 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: 203.040 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 201.974 Da
• Monoisotopic Mass: 201.974 Da
• Topological Polar Surface Area: 48.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 112.000
• 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

Referencias

1. Fuhua Jia, Emmanuel Oluwaseyi Fagbohun, Qianyu Wang, Duoyin Zhu, Jianling Zhang, Bin Gong, Yanbin Cui.  (2021)  Improved thermal conductivity of styrene acrylic resin with carbon nanotubes, graphene and boron nitride hybrid fillers.  Carbon Resources Conversion,      [PMID:] [10.1016/j.crcon.2021.05.001]