β-Bromophenetole - ≥98% , CAS No.589-10-6

CAS: 589-10-6 Cat. No.: B100876 Fórmula: C₈H₉BrO Peso molecular: 201.06 Beilstein Registry Number: 508290 Número CE: 209-634-4

GRADE & PURITY ≥98%

Synonyms

2-bromoethoxyl benzene | BCP22264 | F3308-2964 | NCGC00260395-01 | 1-(2-bromoethoxy)benzene | 2-Phenoxyethylbromide | 2-phenoxy-ethylbromide | DTXSID9049322 | 2-bromoethoxybenzene | Z56950513 | AC-1946 | Tox21_202849 | .beta.-Bromophenetole | beta-Bromoph

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Sinónimos

2-bromoethoxyl benzene | BCP22264 | F3308-2964 | NCGC00260395-01 | 1-(2-bromoethoxy)benzene | 2-Phenoxyethylbromide | 2-phenoxy-ethylbromide | DTXSID9049322 | 2-bromoethoxybenzene | Z56950513 | AC-1946 | Tox21_202849 | .beta.-Bromophenetole | beta-Bromoph

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Protected from light,Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 488184168
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184168
• Sorrisos canónicos: C1=CC=C(C=C1)OCCBr
• IUPAC Name: 2-bromoethoxybenzene
• InChIKey: JJFOBACUIRKUPN-UHFFFAOYSA-N
• INCHI: 1S/C8H9BrO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,6-7H2
• SMILES isoméricas: C1=CC=C(C=C1)OCCBr
• WGK Alemanha: 3
• Peso molecular: 201.06
• Beilstein: 508290
• Reaxy-Rn: 508290
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=508290&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Alkyl aryl ethers Organobromides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• 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

• Solubilidade: Soluble in Methanol
• Sensibilidade: Light sensitive.
• Ponto de congelamento (°C): 32 °C
• Índice de refração: 1.555-1.557
• Ponto de inflamação (°F): 149 °F
• Ponto de inflamação (°C): 65 °C
• Ponto de ebulição (°C): 144°C
• Ponto de fusão (°C): 33.5-34°C
• Peso molecular: 201.060 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 199.984 Da
• Monoisotopic Mass: 199.984 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 79.300
• 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 ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How is this product shipped?

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

How should this product be stored?

Store at room temperature, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

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

The CAS Number is 589-10-6, the molecular formula is C8H9BrO, and the molecular weight is 201.06 g/mol. InChIKey JJFOBACUIRKUPN-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.