3-Bromobiphenyl - analytical standard , CAS No.2113-57-7

CAS: 2113-57-7 Cat. No.: B115166 Fórmula: C12H9Br Peso molecular: 233.1 Número CE: 218-304-9
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
CAS-2113-57-7 | m-Bromobiphenyl | NCGC00091615-02 | DTXSID5024639 | OL10144 | Q27285442 | 3-bromo-1,1' biphenyl | 3-Bromo-1,1'-biphenyl # | O7I53K56S8 | PB47753 | W-107572 | SCHEMBL5164 | 3-Bromodiphenyl | 1-bromo-3-phenyl benzene | A815156 | InChI=1/C12H
Storage
Protected from light,Room temperature
Shipped In
Normal
★
Size
USA
Alemanha (EU)*
Price
Qty
50mg
B115166-50mg
Sob encomenda · 8–12 semanas

116,90US$

136,90US$
Gravar 20,00 US$ (14.61%)
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

Protected from light,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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
CAS-2113-57-7 | m-Bromobiphenyl | NCGC00091615-02 | DTXSID5024639 | OL10144 | Q27285442 | 3-bromo-1,1' biphenyl | 3-Bromo-1,1'-biphenyl # | O7I53K56S8 | PB47753 | W-107572 | SCHEMBL5164 | 3-Bromodiphenyl | 1-bromo-3-phenyl benzene | A815156 | InChI=1/C12H
Especificações e pureza
analytical standard
Condições de armazenamento de armazenamento
Protected from light,Room temperature
Enviado em
Normal
Grau
Padrão analítico
Nomes e identificadores
Sorrisos canónicos
C1=CC=C(C=C1)C2=CC(=CC=C2)Br
IUPAC Name
1-bromo-3-phenylbenzene
InChIKey
USYQKCQEVBFJRP-UHFFFAOYSA-N
INCHI
1S/C12H9Br/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H
SMILES isoméricas
C1=CC=C(C=C1)C2=CC(=CC=C2)Br
WGK Alemanha
3
RTECS
DV1750000
Peso molecular
233.1
Reaxy-Rn
2043191
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2043191&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
SubclassBiphenyls and derivatives
Intermediate Tree Nodes Not available
Direct ParentBrominated biphenyls
Alternative Parents Bromobenzenes  Aryl bromides  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Brominated biphenyl - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as brominated biphenyls. These are organic compounds containing a biphenyl moiety substituted at one or more positions by a bromine atom.
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
KCNH2 Tclin HERG (29587 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
SensibilidadeLight sensitive.
Índice de refração1.637-1.641
Ponto de inflamação (°F)235.4 °F
Ponto de inflamação (°C)110 °C
Ponto de ebulição (°C)299-301°C
Peso molecular233.100 g/mol
XLogP34.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass231.989 Da
Monoisotopic Mass231.989 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count13
Formal Charge0
Complexity149.000
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

Avaliações dos Clientes

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