Hexabromobenzene - analytical standard , CAS No.87-82-1

CAS: 87-82-1 Cat. No.: H114689 Fórmula: C6Br6 Peso molecular: 551.49 Beilstein Registry Number: 1912586 Número CE: 201-773-9
Disponível para encomenda
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
HEXABROMOBENZENE [HSDB] | PLASAFETY HBB | Perbromobenzene | HXBBZ | NSC 113975 | NCGC00164035-01 | LS-13109 | FT-0626943 | UNII-T01859XWIR | DTXCID404128 | 1,2,3,4,5,6-Hexabromobenzene | H0363 | HEXABROMOBENZENE | AI3-60220 | Hexabromobenzene, PESTANAL(R)
Storage
Room temperature
Shipped In
Normal
★
Size
USA
Alemanha (EU)*
Price
Qty
250mg
H114689-250mg
Sob encomenda · 8–12 semanas

70,90US$

83,90US$
Gravar 13,00 US$ (15.49%)
Enter a quantity for the sizes you want to add.
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Why this grade

analytical standard Padrão analítico for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 18 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
HEXABROMOBENZENE [HSDB] | PLASAFETY HBB | Perbromobenzene | HXBBZ | NSC 113975 | NCGC00164035-01 | LS-13109 | FT-0626943 | UNII-T01859XWIR | DTXCID404128 | 1,2,3,4,5,6-Hexabromobenzene | H0363 | HEXABROMOBENZENE | AI3-60220 | Hexabromobenzene, PESTANAL(R)
Especificações e pureza
analytical standard
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Grau
Padrão analítico
Nomes e identificadores
Sorrisos canónicosC1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)Br
IUPAC Name1,2,3,4,5,6-hexabromobenzene
InChIKeyCAYGQBVSOZLICD-UHFFFAOYSA-N
INCHI1S/C6Br6/c7-1-2(8)4(10)6(12)5(11)3(1)9
SMILES isoméricas C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)Br
WGK Alemanha 3
Número UN 3077
Grupo de embalagem III
Peso molecular 551.49
Beilstein 1912586
Reaxy-Rn 1912586
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1912586&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Not available
Direct ParentBromobenzenes
Alternative Parents Aryl bromides  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Bromobenzene - Aryl halide - Aryl bromide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Alvos associados (humanos)
AR Tclin Androgen Receptor (11781 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de ação
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriedades químicas e físicas
Ponto de fusão (°C)>300°C
Peso molecular551.500 g/mol
XLogP36.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass551.504 Da
Monoisotopic Mass545.51 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count12
Formal Charge0
Complexity104.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Calculadoras de soluções
Revisões

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