2-Bromo-2-cyanoacetamide - ≥95% , CAS No.1113-55-9

CAS: 1113-55-9 Cat. No.: B696959 Summenformel: C3H3BrN2O Molekulargewicht: 162.97 EG-Nummer: 680-258-4 PubChem CID: 263631
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GRADE & PURITY ≥95%
Synonyms
Bromocyanoacetamide
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
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Size
Deutschland (EU)
USA*
Price
Qty
50mg
B696959-50mg
Auf Bestellung · 8–12 Wochen
86,69€
250mg
B696959-250mg
Auf Bestellung · 8–12 Wochen
186,48€
1g
B696959-1g
Auf Bestellung · 8–12 Wochen
376,51€
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,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

Synonyme
Bromocyanoacetamide
Spezifikationen & Reinheit
≥95%
Storage
Store at 2-8°C,Argon charged
Verschickt in
Wet ice
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Reinheit
≥95%
Produkteigenschaften
ALogP-0.1
Namen und Kennungen
Kanonisches LächelnC(#N)C(C(=O)N)Br
IUPAC Name2-bromo-2-cyanoacetamide
InChIKeyABBGMXMPOCXVNL-UHFFFAOYSA-N
INCHI1S/C3H3BrN2O/c4-2(1-5)3(6)7/h2H,(H2,6,7)
Isomere SMILES C(#N)C(C(=O)N)Br
PubChem CID 263631
Molekulargewicht 162.97

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 acids and derivatives
KlasseCarboxylic acids and derivatives
SubclassCarboxylic acid derivatives
Intermediate Tree Nodes Carboxylic acid amides
Direct ParentPrimary carboxylic acid amides
Alternative Parents Nitriles  Organopnictogen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl bromides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Primary carboxylic acid amide - Carbonitrile - Nitrile - Alkyl bromide - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as primary carboxylic acid amides. These are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemische und physikalische Eigenschaften
Molekulargewicht162.970 g/mol
XLogP3-0.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass161.943 Da
Monoisotopic Mass161.943 Da
Topological Polar Surface Area66.900 Ų
Heavy Atom Count7
Formal Charge0
Complexity124.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Lösungsrechner
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