2-Bromo-1-ethoxymethylimidazole - ≥97% , CAS No.850429-54-8

CAS: 850429-54-8 Cat. No.: B186972 Fórmula: C₆H₉BrN₂O Peso molecular: 205.1 Número CE: 680-927-0 PubChem CID: 2773257

GRADE & PURITY ≥97%

Synonyms

2-bromo-1-(ethoxymethyl)imidazole | 2-Bromo-1-(ethoxymethyl)-1H-imidazole | MFCD04038915 | D95978 | DTXSID00378312 | AKOS015949487 | 2-Bromo-1-ethoxymethylimidazole | Q-103116 | FT-0687395 | AB17205 | AS-63476 | A841073

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

2-bromo-1-(ethoxymethyl)imidazole | 2-Bromo-1-(ethoxymethyl)-1H-imidazole | MFCD04038915 | D95978 | DTXSID00378312 | AKOS015949487 | 2-Bromo-1-ethoxymethylimidazole | Q-103116 | FT-0687395 | AB17205 | AS-63476 | A841073

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

Sorrisos canónicos

CCOCN1C=CN=C1Br

IUPAC Name

2-bromo-1-(ethoxymethyl)imidazole

InChIKey

FZLPPSCLJGMJCZ-UHFFFAOYSA-N

INCHI

1S/C6H9BrN2O/c1-2-10-5-9-4-3-8-6(9)7/h3-4H,2,5H2,1H3

SMILES isoméricas

CCOCN1C=CN=C1Br

PubChem CID

2773257

Peso molecular

205.1

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Aryl halides
      • Subclass Aryl bromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Aryl halides
• Subclass: Aryl bromides
• Intermediate Tree Nodes: Not available
• Direct Parent: Aryl bromides
• Alternative Parents: N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-substituted imidazole - Aryl bromide - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as aryl bromides. These are organic compounds containing the acyl bromide functional group.
• 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

• Peso molecular: 205.050 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 203.99 Da
• Monoisotopic Mass: 203.99 Da
• Topological Polar Surface Area: 27.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 102.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 850429-54-8, the molecular formula is C6H9BrN2O, and the molecular weight is 205.1 g/mol. InChIKey FZLPPSCLJGMJCZ-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.