2-bromo-3,5-dichloropyrazine - ≥97% , CAS No.1206249-40-2

CAS: 1206249-40-2 Cat. No.: B172535 Formula: C₄HBrCl₂N₂ Peso molecolare: 227.87 Numero EC: 899-683-3

GRADE & PURITY ≥97%

Synonyms

AMY28626 | SB31716 | FT-0750237 | DTXSID30695948 | 2-bromo-3,5-dichloropyrazine | 2-BROMO-3,5-DICHLORO-PYRAZINE | BCP22867 | A857864 | SY100479 | I10188 | DS-14483 | AKOS016000214 | 1206249-40-2 | MFCD14581976 | 2-Bromo-3.5-dichloropyrazine

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

AMY28626 | SB31716 | FT-0750237 | DTXSID30695948 | 2-bromo-3,5-dichloropyrazine | 2-BROMO-3,5-DICHLORO-PYRAZINE | BCP22867 | A857864 | SY100479 | I10188 | DS-14483 | AKOS016000214 | 1206249-40-2 | MFCD14581976 | 2-Bromo-3.5-dichloropyrazine

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Sorrisi canonici

C1=C(N=C(C(=N1)Br)Cl)Cl

IUPAC Name

2-bromo-3,5-dichloropyrazine

InChIKey

CCUUKMSFOYYAKB-UHFFFAOYSA-N

INCHI

1S/C4HBrCl2N2/c5-3-4(7)9-2(6)1-8-3/h1H

Isomeri SMILES

C1=C(N=C(C(=N1)Br)Cl)Cl

Peso molecolare

227.87

Reaxy-Rn

36003018

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=36003018&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Diazines
      • Subclass Pyrazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazines
• Subclass: Pyrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrazines
• Alternative Parents: Aryl chlorides Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrazine - Aryl halide - Aryl chloride - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as pyrazines. These are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms.
• 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

Proprietà chimiche e fisiche

• Peso molecolare: 227.870 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 225.87 Da
• Monoisotopic Mass: 225.87 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 103.000
• 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