Oxalyl bromide solution - 2.0M in methylene chloride , CAS No.15219-34-8

CAS: 15219-34-8 Cat. No.: O466414 分子式: C₂Br₂O₂ 分子量: 215.83 Beilstein Registry Number: 1744440 EC番号: 239-271-7

GRADE & PURITY 2.0M in methylene chloride

Synonyms

BrCOCOBr | MFCD00000113 | Oxalyl bromide | EINECS 239-271-7 | FT-0637202 | JAZLVNXWYDFQFE-UHFFFAOYSA-N | DTXSID9065869 | Oxaly bromide | NSC 96957 | Q-201524 | Ethanedioyl dibromide | NSC96957 | NSC-96957 | Oxalyl bromide, 97% | oxalyl dibromide | UNII-YZ

Storage

Room temperature

概要

Description

Used in synthetic applications of carbon-substituted iminium saltsReactant for:Synthesis of mutasynthons added to cultures ofA. pretiosumfor mutasynthetic generation of ansamitocin derivativesOxalic acid formation from hydroxyl radical substitutionsCyclization to produce CRF1 receptor antagonistsPreparation, optical and electrochemical studies of thiophene end capped olig(2,3-alkylthieno[3,4-b]pyrazine)Asymmetrical synthesis of glycosyl chlorides and bromides

Specifications

同義語

BrCOCOBr | MFCD00000113 | Oxalyl bromide | EINECS 239-271-7 | FT-0637202 | JAZLVNXWYDFQFE-UHFFFAOYSA-N | DTXSID9065869 | Oxaly bromide | NSC 96957 | Q-201524 | Ethanedioyl dibromide | NSC96957 | NSC-96957 | Oxalyl bromide, 97% | oxalyl dibromide | UNII-YZ

仕様と純度

2.0M in methylene chloride

保管条件

Room temperature

名前と識別子

• カノニカル・スマイル: C(=O)(C(=O)Br)Br
• IUPAC Name: oxalyl dibromide
• InChIKey: JAZLVNXWYDFQFE-UHFFFAOYSA-N
• INCHI: 1S/C2Br2O2/c3-1(5)2(4)6
• 異性体SMILES: C(=O)(C(=O)Br)Br
• WGKドイツ: 3
• UN番号: 2922
• 包装グループ: I
• 分子量: 215.83
• Beilstein: 1744440
• Reaxy-Rn: 1744437
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1744437&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • 分類 Acyl halides
      • Subclass Acyl bromides

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

化学的性質と物理的性質

• 沸点（°C）: 16-17°C/10mmHg
• 融点（°C）: -19 °C
• 分子量: 215.830 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 215.824 Da
• Monoisotopic Mass: 213.827 Da
• Topological Polar Surface Area: 34.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 75.500
• 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

よくある質問

How should this product be stored?

Store at room temperature.

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

The CAS Number is 15219-34-8, the molecular formula is BrCOCOBr, and the molecular weight is 215.83 g/mol. InChIKey JAZLVNXWYDFQFE-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.