2-Bromo-4,5-dichloropyridine - ≥95% , CAS No.1033203-42-7

CAS: 1033203-42-7 Cat. No.: B586208 Formula: C₅H₂NCl₂Br Peso molecolare: 226.89 Numero EC: 995-855-8

GRADE & PURITY ≥95%

Synonyms

A921408 | AKOS015966470 | C71139 | AMY17438 | DTXSID601309447 | SY317139 | AB63111 | SCHEMBL23674588 | 1033203-42-7 | DS-11709 | MFCD11100656 | 2-bromo-4,5-dichloropyridine | 2-BroMo-4,5-dichloro-pyridine

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

A921408 | AKOS015966470 | C71139 | AMY17438 | DTXSID601309447 | SY317139 | AB63111 | SCHEMBL23674588 | 1033203-42-7 | DS-11709 | MFCD11100656 | 2-bromo-4,5-dichloropyridine | 2-BroMo-4,5-dichloro-pyridine

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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Purezza

≥95%

Nomi e identificatori

Pubchem Sid

528757099

Sorrisi canonici

C1=C(C(=CN=C1Br)Cl)Cl

IUPAC Name

2-bromo-4,5-dichloropyridine

InChIKey

HLTZXARVZDCGTL-UHFFFAOYSA-N

INCHI

1S/C5H2BrCl2N/c6-5-1-3(7)4(8)2-9-5/h1-2H

Isomeri SMILES

C1=C(C(=CN=C1Br)Cl)Cl

CAS alternativo

1033203-42-7

Peso molecolare

226.89

Reaxy-Rn

37226695

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=37226695&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Halopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Polyhalopyridines
• Alternative Parents: 2-halopyridines Heteroaromatic compounds Imidoyl bromides Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Chloroalkenes Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Polyhalopyridine - 2-halopyridine - Heteroaromatic compound - Imidoyl halide - Imidoyl bromide - Azacycle - Chloroalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl chloride - 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 polyhalopyridines. These are organic compounds containing a pyridine ring substituted at two or more positions by 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

Proprietà chimiche e fisiche

• Peso molecolare: 226.880 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 224.875 Da
• Monoisotopic Mass: 224.875 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 101.000
• 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