[(4-Bromobenzyl)oxy](tert-butyl)dimethylsilane - ≥98%(GC) , CAS No.87736-74-1

CAS: 87736-74-1 Cat. No.: B152542 Peso molecular: 301.3

GRADE & PURITY ≥98%(GC)

Synonyms

((4-Bromobenzyl)oxy)(tert-butyl)dimethylsilane | 4-Tbdms-Hydroxymethylbromobenzene | [(4-bromobenzyl)oxy](t-butyl)dimethylsilane | SY059864 | 4-bromobenzyloxy-tert-butyldimethylsilane | 4-(tert-Butyldimethylsilyloxymethyl)bromobenzene | FT-0651020 | SY055

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

((4-Bromobenzyl)oxy)(tert-butyl)dimethylsilane | 4-Tbdms-Hydroxymethylbromobenzene | [(4-bromobenzyl)oxy](t-butyl)dimethylsilane | SY059864 | 4-bromobenzyloxy-tert-butyldimethylsilane | 4-(tert-Butyldimethylsilyloxymethyl)bromobenzene | FT-0651020 | SY055

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 504765650
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504765650
• Sonrisas canónicas: CC(C)(C)[Si](C)(C)OCC1=CC=C(C=C1)Br
• IUPAC Name: (4-bromophenyl)methoxy-tert-butyl-dimethylsilane
• InChIKey: OURCJXVOBHLREF-UHFFFAOYSA-N
• INCHI: 1S/C13H21BrOSi/c1-13(2,3)16(4,5)15-10-11-6-8-12(14)9-7-11/h6-9H,10H2,1-5H3
• Isómeros SMILES: CC(C)(C)[Si](C)(C)OCC1=CC=C(C=C1)Br
• Peso molecular: 301.3
• Reaxy-Rn: 4400053
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4400053&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Bromobenzenes
• Alternative Parents: Aryl bromides Trialkylheterosilanes Silyl ethers Organic metalloid salts Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromobenzene - Aryl halide - Aryl bromide - Trialkylheterosilane - Silyl ether - Organoheterosilane - Organic metalloid salt - Organic oxygen compound - Hydrocarbon derivative - Organosilicon compound - Organooxygen compound - Organobromide - Organic metalloid moeity - Organohalogen compound - Aromatic homomonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Índice de refracción: 1.51
• Punto de ebullición (°C): 160°C/0.3mmHg(lit.)
• Peso molecular: 301.290 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 300.055 Da
• Monoisotopic Mass: 300.055 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 214.000
• 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

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