2-Bromo-1-(4-iodophenyl)ethanone - ≥95% , CAS No.31827-94-8

CAS: 31827-94-8 Cat. No.: B588706 Peso molecular: 324.95
Disponible para pedir
GRADE & PURITY ≥95%
Synonyms
NCIOpen2_009036 | DTXSID50292534 | A821015 | AC1539 | 7-(2-chlorophenyl)-9,13-dimethyl-4-{2-[4-(2-methylpropyl)phenyl]ethyl}-3-thia-1,8,11,12-tetraazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaene | Ethanone, 2-bromo-1-(4-iodophenyl)- | 2-bromo-4'
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
B588706-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

9,90US$

14,90US$
Guardar 5,00 US$ (33.56%)
5g
B588706-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

28,90US$

43,90US$
Guardar 15,00 US$ (34.17%)
25g
B588706-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

81,90US$

122,90US$
Guardar 41,00 US$ (33.36%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged Ships Wet ice 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
NCIOpen2_009036 | DTXSID50292534 | A821015 | AC1539 | 7-(2-chlorophenyl)-9, 13-dimethyl-4-{2-[4-(2-methylpropyl)phenyl]ethyl}-3-thia-1, 8, 11, 12-tetraazatricyclo[8.3.0.0^{2, 6}]trideca-2(6), 4, 7, 10, 12-pentaene | Ethanone, 2-bromo-1-(4-iodophenyl)- | 2-bromo-4'
Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Protected from light, Argon charged
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥95%
Nombres e identificadores
Sonrisas canónicasC1=CC(=CC=C1C(=O)CBr)I
IUPAC Name2-bromo-1-(4-iodophenyl)ethanone
InChIKeyFSIBMLJFLPWMTD-UHFFFAOYSA-N
INCHI1S/C8H6BrIO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
Isómeros SMILES C1=CC(=CC=C1C(=O)CBr)I
Peso molecular 324.95
Reaxy-Rn 775788
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=775788&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
SuperclassOrganic oxygen compounds
ClaseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones
Direct ParentAlkyl-phenylketones
Alternative Parents Benzoyl derivatives  Aryl alkyl ketones  Iodobenzenes  Aryl iodides  Alpha-haloketones  Organoiodides  Organobromides  Organic oxides  Hydrocarbon derivatives  Alkyl bromides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organohalogen compound - Organobromide - Organoiodide - Alkyl bromide - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Sensibilidadlight sensitive
Peso molecular324.940 g/mol
XLogP33.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass323.865 Da
Monoisotopic Mass323.865 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count11
Formal Charge0
Complexity141.000
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
Calculadoras de soluciones
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