2,4-Dibromopyrimidine - ≥98% , CAS No.3921-01-5

CAS: 3921-01-5 Cat. No.: D184249 Formule: C₄H₂Br₂N₂ Poids moléculaire: 237.88 Numéro CE: 670-386-9

GRADE & PURITY ≥98%

Synonyms

MFCD06798232 | 2,4-Dibromopyrimidine | 2,4-Dibromo-pyrimidine | SCHEMBL383108 | A23376 | AS-18332 | DTXSID40566372 | EN300-111910 | AOEHEEBFRCAFGC-UHFFFAOYSA-N | SY023700 | AKOS015835710 | AM20100033 | PB17395 | FT-0650297 | Pyrimidine, 2,4-dibromo- | dib

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonymes

MFCD06798232 | 2,4-Dibromopyrimidine | 2,4-Dibromo-pyrimidine | SCHEMBL383108 | A23376 | AS-18332 | DTXSID40566372 | EN300-111910 | AOEHEEBFRCAFGC-UHFFFAOYSA-N | SY023700 | AKOS015835710 | AM20100033 | PB17395 | FT-0650297 | Pyrimidine, 2,4-dibromo- | dib

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Store at 2-8°C,Protected from light,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Pubchem Sid

528755461

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528755461

Sourires canoniques

C1=CN=C(N=C1Br)Br

IUPAC Name

2,4-dibromopyrimidine

InChIKey

AOEHEEBFRCAFGC-UHFFFAOYSA-N

INCHI

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

Isomères SMILES

C1=CN=C(N=C1Br)Br

Poids moléculaire

237.88

Reaxy-Rn

636509

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636509&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

• Sensibilité: light sensitive
• Poids moléculaire: 237.880 g/mol
• XLogP3: 2.300
• 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: 78.400
• 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