1,1-dibromo-2,2-bis(chloromethyl)cyclopropane - ≥97% , CAS No.98577-44-7

CAS: 98577-44-7 Cat. No.: D178603 Peso molecular: 296.815 Número EC: 627-508-0

GRADE & PURITY ≥97%

Synonyms

PB48541 | BCP18375 | 1,1-dibromo-2.2-bis(chloromethyl)cyclopropane | AKOS000267676 | 1,1-Dibromo-2,2-bis(chloromethyl)cyclopropane, 90%, technical grade | 1,1-Bis(chloromethyl)-2,2-dibromocyclopropane | EN300-172595 | 1,1-Dibromo-2,2-bis(chloromethyl)cycl

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

1,1-Dibromo-2,2-bis(chloromethyl)cyclopropane is a halogenated cyclopropane derivative. It has been reported to be synthesized from 3-chloro-2-(chloromethyl)-1-propene. It is formed as an intermediate during the synthesis of [1.1.1]propellane by Szeimies method.

Specifications

Sinónimos

PB48541 | BCP18375 | 1, 1-dibromo-2.2-bis(chloromethyl)cyclopropane | AKOS000267676 | 1, 1-Dibromo-2, 2-bis(chloromethyl)cyclopropane, 90%, technical grade | 1, 1-Bis(chloromethyl)-2, 2-dibromocyclopropane | EN300-172595 | 1, 1-Dibromo-2, 2-bis(chloromethyl)cycl

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488190173
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488190173
• Sonrisas canónicas: C1C(C1(Br)Br)(CCl)CCl
• IUPAC Name: 1,1-dibromo-2,2-bis(chloromethyl)cyclopropane
• InChIKey: RCRVZCIUKQNOIS-UHFFFAOYSA-N
• INCHI: 1S/C5H6Br2Cl2/c6-5(7)1-4(5,2-8)3-9/h1-3H2
• Isómeros SMILES: C1C(C1(Br)Br)(CCl)CCl
• Peso molecular: 296.815
• Reaxy-Rn: 3587600
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3587600&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Organochlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Organochlorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organochlorides
• Alternative Parents: Organobromides Hydrocarbon derivatives Alkyl chlorides Alkyl bromides
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Hydrocarbon derivative - Organochloride - Organobromide - Alkyl halide - Alkyl chloride - Alkyl bromide - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
• 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

• Sensibilidad: air sensitive
• Punto de fusión (°C): 48-50 °C
• Peso molecular: 296.810 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 295.819 Da
• Monoisotopic Mass: 293.821 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 120.000
• 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