2-Amino-5-bromopyrimidine - ≥98% , CAS No.7752-82-1

CAS: 7752-82-1 Cat. No.: A123409 Peso molecular: 174 Número EC: 629-581-4

GRADE & PURITY ≥98%

Synonyms

5-Bromo-2-pyrimidinamine | AC-907/25014021 | CL1918 | SR-01000639998-1 | Z729558264 | 2-Amino-5-bromopyrimidine;2-Amino-5-bromopyrimidine | A9811 | InChI=1/C4H4BrN3/c5-3-1-7-4(6)8-2-3/h1-2H,(H2,6,7,8) | W-203779 | AC-8659 | BCP22782 | BBL100146 | BS-28500

Storage

Store at 2-8°C

Shipped In

Wet ice

Descripción general

Intermediate for the preparation of sulfanilamides and amino acids containing the pyrimidine ring system. The products are potential antiviral agents.

application：

2-Amino-5-bromopyrimidine was employed:

in synthesis of pyridine, pyrimidine and pyridinone C-nucleoside phosphoramidites

in synthesis of 2-phthalimido-5-bromopyrimidine

as intermediate for the preparation of sulfanilamides and amino acids containing the pyrimidine ring system. The products are potential antiviral agents.

Specifications

Sinónimos

5-Bromo-2-pyrimidinamine | AC-907/25014021 | CL1918 | SR-01000639998-1 | Z729558264 | 2-Amino-5-bromopyrimidine;2-Amino-5-bromopyrimidine | A9811 | InChI=1/C4H4BrN3/c5-3-1-7-4(6)8-2-3/h1-2H, (H2, 6, 7, 8) | W-203779 | AC-8659 | BCP22782 | BBL100146 | BS-28500

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488188820
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188820
• Sonrisas canónicas: C1=C(C=NC(=N1)N)Br
• IUPAC Name: 5-bromopyrimidin-2-amine
• InChIKey: UHRHPPKWXSNZLR-UHFFFAOYSA-N
• INCHI: 1S/C4H4BrN3/c5-3-1-7-4(6)8-2-3/h1-2H,(H2,6,7,8)
• Isómeros SMILES: C1=C(C=NC(=N1)N)Br
• WGK Alemania: 3
• Peso molecular: 174
• Reaxy-Rn: 111376
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=111376&ln=

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: Halopyrimidines
• Alternative Parents: Aminopyrimidines and derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Halopyrimidine - Aminopyrimidine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- 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

• Punto de fusión (°C): 244°C
• Peso molecular: 174.000 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 172.959 Da
• Monoisotopic Mass: 172.959 Da
• Topological Polar Surface Area: 51.800 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 69.700
• 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