Bromoacetyl Chloride - ≥85%(GC) , CAS No.22118-09-8

CAS: 22118-09-8 Cat. No.: B137113 Fórmula: C₂H₂BrClO Peso molecular: 157.39 Beilstein Registry Number: 2215 Número CE: 244-790-7

GRADE & PURITY ≥85%(GC)

Synonyms

FT-0623221 | alpha-bromoacetyl chloride | Bromoacetyl chloride, >=95% (GC) | Bromoacetyl chloride | bromo-acetyl chloride | NSC 97376 | MFCD00000724 | NSC97376 | NSC-97376 | 1,3-thiazole-2-thiol | 2-bromoacetyl chloride | 4-Imidazoline-2-thione | bromacet

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

The competitive photodissociation of bromoacetyl chloride has been studied by ab initio methods. 

Product description

Bromoacetyl chloride was used in the synthesis of α,α-disubstituted thioisomünchnones. It was also used in the preparation of 1,3-dibromoacetone.

Specifications

Sinónimos

FT-0623221 | alpha-bromoacetyl chloride | Bromoacetyl chloride, >=95% (GC) | Bromoacetyl chloride | bromo-acetyl chloride | NSC 97376 | MFCD00000724 | NSC97376 | NSC-97376 | 1,3-thiazole-2-thiol | 2-bromoacetyl chloride | 4-Imidazoline-2-thione | bromacet

Especificações e pureza

≥85%(GC)

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥85%(GC)

Nomes e identificadores

Pubchem Sid

508814522

Sorrisos canónicos

C(C(=O)Cl)Br

IUPAC Name

2-bromoacetyl chloride

InChIKey

SYZRZLUNWVNNNV-UHFFFAOYSA-N

INCHI

1S/C2H2BrClO/c3-1-2(4)5/h1H2

SMILES isoméricas

C(C(=O)Cl)Br

WGK Alemanha

3

Peso molecular

157.39

Beilstein

2215

Reaxy-Rn

1209323

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1209323&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Acyl halides
      • Subclass Acyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Acyl halides
• Subclass: Acyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl chlorides
• Alternative Parents: Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organobromide - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as acyl chlorides. These are organic compounds containing the functional group -CO-Cl.
• 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

Propriedades químicas e físicas

• Sensibilidade: heat sensitive,light sensitive,Hygroscopic
• Índice de refração: 1.49
• Ponto de ebulição (°C): 128 °C
• Peso molecular: 157.390 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 155.898 Da
• Monoisotopic Mass: 155.898 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 44.900
• 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