2-Bromophenethyl alcohol - ≥98% , CAS No.1074-16-4

CAS: 1074-16-4 Cat. No.: B102011 Summenformel: C₈H₉BrO Molekulargewicht: 201.06 EG-Nummer: 839-968-1

GRADE & PURITY ≥98%

Synonyms

2-bromophenyl ethyl alcohol | SCHEMBL286557 | 2-(2-Bromophenyl)ethanol | 2-(2-bromo-phenyl)-ethanol | EN300-212273 | 2-(2-Bromophenyl)ethyl Alcohol | B3516 | FT-0608437 | MFCD00093566 | STL555963 | SY011299 | F0001-0153 | 2-(2-Bromophenyl)Ethan-1-Ol | BBL

Storage

Protected from light,Room temperature

Shipped In

Normal

Übersicht

2-Bromophenethyl alcohol is a phenethyl alcohol derivative. It participates in the preparation of novel P-chirogenic phosphines with a sulfur-chelating arm (P*,S-hybrid ligand).

Specifications

Synonyme

2-bromophenyl ethyl alcohol | SCHEMBL286557 | 2-(2-Bromophenyl)ethanol | 2-(2-bromo-phenyl)-ethanol | EN300-212273 | 2-(2-Bromophenyl)ethyl Alcohol | B3516 | FT-0608437 | MFCD00093566 | STL555963 | SY011299 | F0001-0153 | 2-(2-Bromophenyl)Ethan-1-Ol | BBL

Spezifikationen & Reinheit

≥98%

Storage

Protected from light,Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488192481
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192481
• Kanonisches Lächeln: C1=CC=C(C(=C1)CCO)Br
• IUPAC Name: 2-(2-bromophenyl)ethanol
• InChIKey: ADLOWZRDUHSVRU-UHFFFAOYSA-N
• INCHI: 1S/C8H9BrO/c9-8-4-2-1-3-7(8)5-6-10/h1-4,10H,5-6H2
• Isomere SMILES: C1=CC=C(C(=C1)CCO)Br
• WGK Deutschland: 3
• Molekulargewicht: 201.06
• Reaxy-Rn: 2326445
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2326445&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: Bromobenzenes
• Alternative Parents: Aryl bromides Primary alcohols Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromobenzene - Aryl halide - Aryl bromide - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organobromide - Organohalogen compound - Alcohol - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light sensitive.
• Brechungsindex: 1.577
• Flammpunkt (°F): >235.4 °F
• Flammpunkt (°C): 110℃
• Siedepunkt (°C): 97°C/0.7mmHg
• Molekulargewicht: 201.060 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 199.984 Da
• Monoisotopic Mass: 199.984 Da
• Topological Polar Surface Area: 20.200 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