Bromoacetyl Chloride - ≥95% , CAS No.22118-09-8

CAS: 22118-09-8 Cat. No.: B164459 Formula: C₂H₂BrClO Peso molecolare: 157.39 Beilstein Registry Number: 2215 Numero EC: 244-790-7

GRADE & PURITY ≥95%

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

Panoramica

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

Specifications

Sinonimi

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

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥95%

Nomi e identificatori

• Sorrisi canonici: C(C(=O)Cl)Br
• IUPAC Name: 2-bromoacetyl chloride
• InChIKey: SYZRZLUNWVNNNV-UHFFFAOYSA-N
• INCHI: 1S/C2H2BrClO/c3-1-2(4)5/h1H2
• Isomeri SMILES: C(C(=O)Cl)Br
• WGK Germania: 3
• Peso molecolare: 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
• Descrizione: 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

Proprietà chimiche e fisiche

• Sensibilità: heat sensitive,light sensitive,Hygroscopic
• Indice di rifrazione: 1.49
• Punto di ebollizione (°C): 128 °C
• Peso molecolare: 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

Riferimenti

1. Lusi Zhang, Zhiyuan Ma, Ruili Wang, Weiwei Zuo, Meifang Zhu.  (2023)  Bis-quaternary ammonium betulin-based dimethacrylate: synthesis, characterization, and application in dental restorative resins.  Materials Advances,  4  (9): (2127-2137).  [PMID:] [10.1039/D3MA00016H]

Domande frequenti

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 22118-09-8, the molecular formula is C2H2BrClO, and the molecular weight is 157.39 g/mol. InChIKey SYZRZLUNWVNNNV-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.