Bromotrichloromethane - ≥97% , CAS No.75-62-7

CAS: 75-62-7 Cat. No.: B139244 Fórmula: BrCCl₃ Peso molecular: 198.27 Beilstein Registry Number: 1732543 Número EC: 200-886-0

GRADE & PURITY ≥97%

Synonyms

AKOS015833938 | Bromotrichloromethane, 99% | BR1357 | Tox21_303534 | B0662 | bromo trichloromethane | BROMOTRICHLOROMETHANE [HSDB] | CBrCl3 | AS-57509 | NCGC00249206-01 | NSC 8017 | Trichloromethyl bromide | Q23780617 | Caswell No. 118 | Methane, bromotri

Storage

Room temperature

Shipped In

Normal

Descripción general

A chain transfer agent for radical polymerization of methacrylates. Brominating reagent. Reagent for the bromination of active hydrogen compounds. Used for the preparation of a dichloromethylenephosphorane, a Wittig reagent.

Specifications

Sinónimos

AKOS015833938 | Bromotrichloromethane, 99% | BR1357 | Tox21_303534 | B0662 | bromo trichloromethane | BROMOTRICHLOROMETHANE [HSDB] | CBrCl3 | AS-57509 | NCGC00249206-01 | NSC 8017 | Trichloromethyl bromide | Q23780617 | Caswell No. 118 | Methane, bromotri

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

Pubchem Sid

488180060

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180060

Sonrisas canónicas

C(Cl)(Cl)(Cl)Br

IUPAC Name

bromo(trichloro)methane

InChIKey

XNNQFQFUQLJSQT-UHFFFAOYSA-N

INCHI

1S/CBrCl3/c2-1(3,4)5

Isómeros SMILES

C(Cl)(Cl)(Cl)Br

WGK Alemania

3

RTECS

PA5400000

Peso molecular

198.27

Beilstein

1732543

Reaxy-Rn

1732543

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732543&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Alkyl halides
      • Subclass Halomethanes

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Alkyl halides
• Subclass: Halomethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Halomethanes
• Alternative Parents: Organochlorides Organobromides Hydrocarbon derivatives Alkyl chlorides Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Halomethane - Hydrocarbon derivative - Organochloride - Organobromide - Alkyl chloride - Alkyl bromide - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as halomethanes. These are organic compounds in which at least one of the four hydrogen atoms of methane (CH4) are replaced by halogen atoms.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Not miscible or difficult to mix in water.
• Índice de refracción: 1.506
• Punto de ebullición (°C): 104°C
• Punto de fusión (°C): -6°C
• Peso molecular: 198.270 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 195.825 Da
• Monoisotopic Mass: 195.825 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 28.400
• 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