cis-1-Bromo-2-ethoxyethylene - technical grade, ≥85%(GC) , CAS No.23521-49-5

CAS: 23521-49-5 Cat. No.: C432351 Peso molecular: 151 Número EC: 245-712-4

GRADE & PURITY Technical grade

Synonyms

Ethyl (2R,3S)-2-tert-butyloxycarbonylamino-3-phenyl-3-hydroxypropanoate | cis-1-Bromo-2-ethoxyethylene, technical, ~85% (GC) | BBL103843 | NSC617631 | NSC-617631 | SCHEMBL376777 | STL557653 | 1-Bromo-2-ethoxyethyl-(Z)-ene | (Z)-1-bromo-2-ethoxyethene | J-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Other Notes

Used to prepare the lithium compound

Specifications

Sinónimos

Ethyl (2R, 3S)-2-tert-butyloxycarbonylamino-3-phenyl-3-hydroxypropanoate | cis-1-Bromo-2-ethoxyethylene, technical, ~85% (GC) | BBL103843 | NSC617631 | NSC-617631 | SCHEMBL376777 | STL557653 | 1-Bromo-2-ethoxyethyl-(Z)-ene | (Z)-1-bromo-2-ethoxyethene | J-

Especificaciones y pureza

technical grade, ≥85%(GC)

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Technical grade

Nombres e identificadores

• Sonrisas canónicas: CCOC=CBr
• IUPAC Name: (Z)-1-bromo-2-ethoxyethene
• InChIKey: BCFCTTHZFYZOHT-ARJAWSKDSA-N
• INCHI: 1S/C4H7BrO/c1-2-6-4-3-5/h3-4H,2H2,1H3/b4-3-
• Isómeros SMILES: CCO/C=C\Br
• Peso molecular: 151
• Reaxy-Rn: 1738200
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1738200&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Vinyl halides
      • Subclass Vinyl bromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Vinyl halides
• Subclass: Vinyl bromides
• Intermediate Tree Nodes: Not available
• Direct Parent: Vinyl bromides
• Alternative Parents: Bromoalkenes Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Bromoalkene - Haloalkene - Vinyl bromide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as vinyl bromides. These are vinyl halides in which a bromine atom is bonded to an sp2-hybridised carbon atom.
• 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

Propiedades químicas y físicas

• Índice de refracción: 1.474
• Punto de inflamación (°F): 52 °C
• Punto de inflamación (°C): 52°C
• Punto de ebullición (°C): 139-142 °C
• Peso molecular: 151.000 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 149.968 Da
• Monoisotopic Mass: 149.968 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 42.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1