2,5-Dibromopyrimidine - ≥97% , CAS No.32779-37-6

CAS: 32779-37-6 Cat. No.: D121632 Formule: C₄H₂Br₂N₂ Poids moléculaire: 237.88 Numéro CE: 689-451-8

GRADE & PURITY ≥97%

Synonyms

SCHEMBL198651 | BBL101687 | Pyrimidine, 2,5-dibromo- | XAHITOJPIWZJHD-UHFFFAOYSA-N | D4225 | 2,5-dibromopyrimidine | 2,5-dibromo-Pyrimidine | SY015869 | 2,5-Dibromopyrimidine, 97% | A821409 | AM20090482 | AKOS007930456 | EN300-67369 | MFCD08275684 | DTXSI

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonymes

SCHEMBL198651 | BBL101687 | Pyrimidine, 2,5-dibromo- | XAHITOJPIWZJHD-UHFFFAOYSA-N | D4225 | 2,5-dibromopyrimidine | 2,5-dibromo-Pyrimidine | SY015869 | 2,5-Dibromopyrimidine, 97% | A821409 | AM20090482 | AKOS007930456 | EN300-67369 | MFCD08275684 | DTXSI

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

Pubchem Sid

488196978

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488196978

Sourires canoniques

C1=C(C=NC(=N1)Br)Br

IUPAC Name

2,5-dibromopyrimidine

InChIKey

XAHITOJPIWZJHD-UHFFFAOYSA-N

INCHI

1S/C4H2Br2N2/c5-3-1-7-4(6)8-2-3/h1-2H

Isomères SMILES

C1=C(C=NC(=N1)Br)Br

WGK Allemagne

3

Poids moléculaire

237.88

Reaxy-Rn

636510

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636510&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazines
      • Subclass Pyrimidines and pyrimidine derivatives
        • Level5 Halopyrimidines
          • Level6 2-halopyrimidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazines
• Subclass: Pyrimidines and pyrimidine derivatives
• Intermediate Tree Nodes: Halopyrimidines
• Direct Parent: 2-halopyrimidines
• Alternative Parents: Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-halopyrimidine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as 2-halopyrimidines. These are aromatic compounds containing a pyrimidine ring substituted at the 2-position with a halogen atom.
• 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

Propriétés chimiques et physiques

• Solubilité: Soluble in Methanol
• Sensibilité: Air sensitive
• Point de fusion (°C): 82-86°C
• Poids moléculaire: 237.880 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 237.856 Da
• Monoisotopic Mass: 235.858 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 70.400
• 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

Foire aux questions

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 room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 32779-37-6, the molecular formula is C4H2Br2N2, and the molecular weight is 237.88 g/mol. InChIKey XAHITOJPIWZJHD-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.