2-(2'-Bromo-4'-fluorofenossi)propano - ≥95% , CAS No.202865-79-0

CAS: 202865-79-0 Cat. No.: B182591 Formula: C₉H₁₀BrFO Peso molecolare: 233.1

GRADE & PURITY ≥95%

Synonyms

2-bromo-4-fluoro-1-isopropoxybenzene | 2-bromo-4-fluoro-1-isopropoxy-benzene | 2-bromo4-fluoro-1-isopropoxy-benzene | SCHEMBL4349038 | FT-0709869 | A814395 | MFCD00070761 | 2-bromo-4-fluoro-1-propan-2-yloxybenzene | 2-Bromo-4-fluoro-1-(1-methylethoxy)benz

Storage

Temperatura ambiente

Shipped In

Normale

Specifications

Sinonimi

2-bromo-4-fluoro-1-isopropoxybenzene | 2-bromo-4-fluoro-1-isopropoxy-benzene | 2-bromo4-fluoro-1-isopropoxy-benzene | SCHEMBL4349038 | FT-0709869 | A814395 | MFCD00070761 | 2-bromo-4-fluoro-1-propan-2-yloxybenzene | 2-Bromo-4-fluoro-1-(1-methylethoxy)benz

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Temperatura ambiente

Spedito in

Normale

Purezza

≥95%

Nomi e identificatori

• Sorrisi canonici: CC(C)OC1=C(C=C(C=C1)F)Br
• IUPAC Name: 2-bromo-4-fluoro-1-propan-2-yloxybenzene
• InChIKey: HFSLIMXPHXLCKX-UHFFFAOYSA-N
• INCHI: 1S/C9H10BrFO/c1-6(2)12-9-4-3-7(11)5-8(9)10/h3-6H,1-2H3
• Isomeri SMILES: CC(C)OC1=C(C=C(C=C1)F)Br
• Peso molecolare: 233.1
• Reaxy-Rn: 11156974
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11156974&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 Fluorobenzenes Bromobenzenes Alkyl aryl ethers Aryl fluorides Aryl bromides Organofluorides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Ether - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organofluoride - Organohalogen compound - Organobromide - Aromatic homomonocyclic compound
• Descrizione: 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

Proprietà chimiche e fisiche

• Peso molecolare: 233.080 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 231.99 Da
• Monoisotopic Mass: 231.99 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 140.000
• 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

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 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 202865-79-0, the molecular formula is C9H10BrFO, and the molecular weight is 233.1 g/mol. InChIKey HFSLIMXPHXLCKX-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.