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

CAS: 75-62-7 Cat. No.: B139244 分子式: BrCCl₃ 分子量: 198.27 Beilstein Registry Number: 1732543 EC番号: 200-886-0

グレード＆純度 ≥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

概要

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.

仕様

同義語

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

仕様と純度

≥97%

保管条件

Room temperature

入荷

Normal

純度

≥97%

名前と識別子

パブケム・シド

488180060

パブケム・シド・ウル

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

カノニカル・スマイル

C(Cl)(Cl)(Cl)Br

IUPAC Name

bromo(trichloro)methane

InChIKey

XNNQFQFUQLJSQT-UHFFFAOYSA-N

INCHI

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

異性体SMILES

C(Cl)(Cl)(Cl)Br

WGKドイツ

3

RTECS

PA5400000

分子量

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
    • 分類 Alkyl halides
      • Subclass Halomethanes

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• 分類: 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
• 説明: 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

作用メカニズム

化学的性質と物理的性質

• 溶解度: Not miscible or difficult to mix in water.
• 屈折率: 1.506
• 沸点（°C）: 104°C
• 融点（°C）: -6°C
• 分子量: 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