2-Chlorophenethyl bromide - ≥97% , CAS No.16793-91-2

CAS: 16793-91-2 Cat. No.: C167804 Summenformel: C₈H₈BrCl Molekulargewicht: 219.51 EG-Nummer: 627-490-4

GRADE & PURITY ≥97%

Synonyms

AM83054 | 1-(2-bromo-ethyl)-2-chlorobenzene | 1-(2-Bromo-ethyl)-2-chloro-benzene | 1-(2-bromoethyl)-2-chlorobenzene | 1-(2-bromoethyl)-2-chloro-benzene | DTXSID90373659 | 1-(bromoethyl)-2-chlorobenzene | MFCD04117464 | SY004845 | FT-0647568 | 2-Chlorophen

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

AM83054 | 1-(2-bromo-ethyl)-2-chlorobenzene | 1-(2-Bromo-ethyl)-2-chloro-benzene | 1-(2-bromoethyl)-2-chlorobenzene | 1-(2-bromoethyl)-2-chloro-benzene | DTXSID90373659 | 1-(bromoethyl)-2-chlorobenzene | MFCD04117464 | SY004845 | FT-0647568 | 2-Chlorophen

Spezifikationen & Reinheit

≥97%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Pubchem Sid: 488193044
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488193044
• Kanonisches Lächeln: C1=CC=C(C(=C1)CCBr)Cl
• IUPAC Name: 1-(2-bromoethyl)-2-chlorobenzene
• InChIKey: AECBVDLERUETKG-UHFFFAOYSA-N
• INCHI: 1S/C8H8BrCl/c9-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2
• Isomere SMILES: C1=CC=C(C(=C1)CCBr)Cl
• WGK Deutschland: 2
• Molekulargewicht: 219.51
• Reaxy-Rn: 2326444
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2326444&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Chlorobenzenes
• Alternative Parents: Aryl chlorides Organochlorides Organobromides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Chlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
• 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Moisture sensitive.
• Brechungsindex: 1.5707
• Flammpunkt (°F): >230 °F
• Flammpunkt (°C): >110 °C
• Siedepunkt (°C): 112°C/10mmHg
• Molekulargewicht: 219.500 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 217.95 Da
• Monoisotopic Mass: 217.95 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 95.300
• 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