2-(2-Bromoethoxy)anisole - ≥97% , CAS No.4463-59-6

CAS: 4463-59-6 Cat. No.: B133710 Fórmula: C₉H₁₁BrO₂ Peso molecular: 231.09 Número CE: 402-010-4

GRADE & PURITY ≥97%

Synonyms

2-(2-Bromoethoxy)-1-methoxybenzene | BBL027843 | SCHEMBL3528579 | BB 0217822 | AC-5630 | PBRPKYRJVDJZTF-UHFFFAOYSA-N | DTXSID20365183 | 2-methoxyphenoxy ethylbromide | 2-(2-Bromoethoxy)anisole | EC 402-010-4 | 2-bromoethyl 2-methoxyphenyl ether | DS-16586

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

2-(2-Bromoethoxy)-1-methoxybenzene | BBL027843 | SCHEMBL3528579 | BB 0217822 | AC-5630 | PBRPKYRJVDJZTF-UHFFFAOYSA-N | DTXSID20365183 | 2-methoxyphenoxy ethylbromide | 2-(2-Bromoethoxy)anisole | EC 402-010-4 | 2-bromoethyl 2-methoxyphenyl ether | DS-16586

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

488192004

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488192004

Sorrisos canónicos

COC1=CC=CC=C1OCCBr

IUPAC Name

1-(2-bromoethoxy)-2-methoxybenzene

InChIKey

PBRPKYRJVDJZTF-UHFFFAOYSA-N

INCHI

1S/C9H11BrO2/c1-11-8-4-2-3-5-9(8)12-7-6-10/h2-5H,6-7H2,1H3

SMILES isoméricas

COC1=CC=CC=C1OCCBr

Peso molecular

231.09

Reaxy-Rn

511581

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=511581&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers
      • Subclass Anisoles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Anisoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Anisoles
• Alternative Parents: Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Organobromides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Methoxybenzene - Anisole - 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 anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
• 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: 231.090 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 229.994 Da
• Monoisotopic Mass: 229.994 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 119.000
• 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 4463-59-6, the molecular formula is C9H11BrO2, and the molecular weight is 231.09 g/mol. InChIKey PBRPKYRJVDJZTF-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.