1,2-Dibromo-1,1,2,2-tetrachloroethane - ≥97%(GC) , CAS No.630-25-1

CAS: 630-25-1 Cat. No.: D155305 Molecular Weight: 325.63 EC Number: 211-136-7

GRADE & PURITY ≥97%(GC)

Synonyms

EINECS 211-136-7 | 1,2-dibrom-tetrachlorethane | SCHEMBL320888 | UNII-0SGG217EFR | FT-0606365 | tetra-chloro-1,2-dibromo-ethane | 1,2-dibromo-1,1,2,2,-tetrachloroethane | FS-4013 | D1987 | EN300-175963 | BrCCl2CCl2Br | 1,2-Dibromo-1,1,2,2-tetrachloroethan

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

EINECS 211-136-7 | 1, 2-dibrom-tetrachlorethane | SCHEMBL320888 | UNII-0SGG217EFR | FT-0606365 | tetra-chloro-1, 2-dibromo-ethane | 1, 2-dibromo-1, 1, 2, 2, -tetrachloroethane | FS-4013 | D1987 | EN300-175963 | BrCCl2CCl2Br | 1, 2-Dibromo-1, 1, 2, 2-tetrachloroethan

Specifications & Purity

≥97%(GC)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥97%(GC)

Names and Identifiers

• Pubchem Sid: 488184322
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184322
• Canonical Smiles: C(C(Cl)(Cl)Br)(Cl)(Cl)Br
• IUPAC Name: 1,2-dibromo-1,1,2,2-tetrachloroethane
• InChIKey: WJUKOGPNGRUXMG-UHFFFAOYSA-N
• INCHI: 1S/C2Br2Cl4/c3-1(5,6)2(4,7)8
• Isomeric SMILES: C(C(Cl)(Cl)Br)(Cl)(Cl)Br
• WGK Germany: 3
• RTECS: KH9366000
• Molecular Weight: 325.63
• Reaxy-Rn: 1699471
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1699471&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Class Organochlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Class: Organochlorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organochlorides
• Alternative Parents: Organobromides Hydrocarbon derivatives Alkyl chlorides Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organochloride - Organobromide - Alkyl halide - Alkyl chloride - Alkyl bromide - Aliphatic acyclic compound
• Description: 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

Chemical and Physical Properties

• Solubility: Insoluble in water
• Sensitivity: Air 、Light、Heat sensitive
• Melt Point(°C): 215-220°C
• Molecular Weight: 325.600 g/mol
• XLogP3: 4.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 325.707 Da
• Monoisotopic Mass: 321.712 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 78.000
• 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