5-Bromo-4,6-difluoropyrimidine - ≥96% , CAS No.946681-88-5

CAS: 946681-88-5 Cat. No.: B335681 Peso molecular: 194.97 Número EC: 635-627-4
Disponible para pedir
GRADE & PURITY ≥96%
Synonyms
DTXSID00649857 | FT-0756369 | SB57476 | A900139 | 5-Bromo-4,6-difluoropyrimidine | BS-17957 | C4HBrF2N2 | EN300-298684 | MFCD08686978 | J-517062 | AKOS005254926 | D75129
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
B335681-250mg
2

54,90US$

82,90US$
Guardar 28,00 US$ (33.78%)
1g
B335681-1g
2

125,90US$

188,90US$
Guardar 63,00 US$ (33.35%)
5g
B335681-5g
1

472,90US$

709,90US$
Guardar 237,00 US$ (33.38%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥96% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
DTXSID00649857 | FT-0756369 | SB57476 | A900139 | 5-Bromo-4, 6-difluoropyrimidine | BS-17957 | C4HBrF2N2 | EN300-298684 | MFCD08686978 | J-517062 | AKOS005254926 | D75129
Especificaciones y pureza
≥96%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥96%
Nombres e identificadores
Pubchem Sid488200794
Sonrisas canónicasC1=NC(=C(C(=N1)F)Br)F
IUPAC Name5-bromo-4,6-difluoropyrimidine
InChIKeyXIBSHDQUWTUSAI-UHFFFAOYSA-N
INCHI1S/C4HBrF2N2/c5-2-3(6)8-1-9-4(2)7/h1H
Isómeros SMILES C1=NC(=C(C(=N1)F)Br)F
Peso molecular 194.97
Reaxy-Rn 57537528
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=57537528&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
SuperclassOrganoheterocyclic compounds
ClaseDiazines
SubclassPyrimidines and pyrimidine derivatives
Intermediate Tree Nodes Not available
Direct ParentHalopyrimidines
Alternative Parents Aryl fluorides  Aryl bromides  Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Organofluorides  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Halopyrimidine - Aryl halide - Aryl fluoride - Aryl bromide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
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:

Find and download the COA for your product by matching the lot number on the packaging.

7 results found

Lot NumberCertificate TypeFechaArticulo
I2227236Certificate of AnalysisJul 10, 2025 B335681
I2227071Certificate of AnalysisJul 09, 2025 B335681
C2406299Certificate of AnalysisMar 16, 2024 B335681
C2406318Certificate of AnalysisMar 16, 2024 B335681
C2406323Certificate of AnalysisMar 16, 2024 B335681
C2528062Certificate of AnalysisMar 16, 2024 B335681
I2227043Certificate of AnalysisJul 12, 2022 B335681
Propiedades químicas y físicas
Punto de fusión (°C)74-80 °C
Peso molecular194.960 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass193.929 Da
Monoisotopic Mass193.929 Da
Topological Polar Surface Area25.800 Ų
Heavy Atom Count9
Formal Charge0
Complexity92.600
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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