Éter de decabromodifenilo - ≥98% , CAS No.1163-19-5

CAS: 1163-19-5 Cat. No.: D106569 Fórmula: C₁₂Br₁₀O Peso molecular: 959.17 Beilstein Registry Number: 2188438 Número EC: 214-604-9 PubChem CID: 14410

GRADE & PURITY ≥98%

Synonyms

2,2',3,3',4,4',5,5',6,6'-éter de decabromobifenilo | Éter de decabromodifenilo (DBDPE) | Thermoguard 505 | CHEBI:82436 | DS-6350 | EINECS 214-604-9 | Éter de perbromodifenilo | Planelon DB 100 | SCHEMBL33901 | Caliban F/R-P 39P | NCGC00357196-01 | UNII-N8

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

2,2',3,3',4,4',5,5',6,6'-éter de decabromobifenilo | Éter de decabromodifenilo (DBDPE) | Thermoguard 505 | CHEBI:82436 | DS-6350 | EINECS 214-604-9 | Éter de perbromodifenilo | Planelon DB 100 | SCHEMBL33901 | Caliban F/R-P 39P | NCGC00357196-01 | UNII-N8

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥98%

Nombres e identificadores

Sonrisas canónicas

C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br

IUPAC Name

1,2,3,4,5-pentabromo-6-(2,3,4,5,6-pentabromophenoxy)benzene

InChIKey

WHHGLZMJPXIBIX-UHFFFAOYSA-N

INCHI

1S/C12Br10O/c13-1-3(15)7(19)11(8(20)4(1)16)23-12-9(21)5(17)2(14)6(18)10(12)22

Isómeros SMILES

C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br

WGK Alemania

1

RTECS

KN3525000

PubChem CID

14410

Peso molecular

959.17

Beilstein

2188438

Reaxy-Rn

2188438

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Bromodiphenyl ethers
• Alternative Parents: Diarylethers Phenoxy compounds Phenol ethers Bromobenzenes Aryl bromides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromodiphenyl ether - Diaryl ether - Phenoxy compound - Phenol ether - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as bromodiphenyl ethers. These are compounds that contain two benzene groups linked to each other via an ether bond, and where at least one ring is substituted with a bromo group.
• External Descriptors: organobromine compound - aromatic ether

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

• Punto de ebullición (°C): 425°C
• Punto de fusión (°C): 304-309°C
• Peso molecular: 959.200 g/mol
• XLogP3: 10.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 959.168 Da
• Monoisotopic Mass: 949.178 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 345.000
• 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

Preguntas frecuentes

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1163-19-5, the molecular formula is C12Br10O, and the molecular weight is 959.17 g/mol. InChIKey WHHGLZMJPXIBIX-UHFFFAOYSA-N.

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.