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

CAS: 3921-01-5 Cat. No.: D184249 Summenformel: C₄H₂Br₂N₂ Molekulargewicht: 237.88 EG-Nummer: 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

Synonyme

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

Spezifikationen & Reinheit

≥98%

Storage

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

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 528755461
• Kanonisches Lächeln: 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
• Isomere SMILES: C1=CN=C(N=C1Br)Br
• Molekulargewicht: 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
    • Klasse Diazines
      • Subclass Pyrimidines and pyrimidine derivatives
        • Ebene5 Halopyrimidines
          • Ebene6 2-halopyrimidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: 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
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: light sensitive
• Molekulargewicht: 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