Aminomalononitrile p-Toluenesulfonate - ≥98%(T) , CAS No.5098-14-6

CAS: 5098-14-6 Cat. No.: A151543 Peso molecular: 253.28 Beilstein Registry Number: 4050750 Número EC: 225-817-1
Disponible para pedir
GRADE & PURITY ≥98%(T)
Synonyms
Aminomalononitrile p-toluenesulfonate;2-Aminomalononitrile 4-methylbenzenesulfonate | SB18326 | Aminomalonitrile toluene-4-sulfonate | MFCD00012848 | FT-0622292 | 2-Aminomalononitrile 4-methylbenzenesulfonate | 2-Aminomalononitrile toluene-4-sulfonate | A
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
A151543-250mg
4
9,90US$
1g
A151543-1g
4
12,90US$
5g
A151543-5g
4
15,90US$
25g
A151543-25g
3
78,90US$
100g
A151543-100g
5
220,90US$
500g
A151543-500g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.093,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(T) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C,Argon charged Ships Ice chest + Ice pads 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.

Descripción general

Application

Aminomalononitrile p-toluenesulfonate was used in the syntheiss of 1-substituted 5-amino-4-cyano-2-hydroxyimidazoles.

Specifications

Sinónimos
Aminomalononitrile p-toluenesulfonate;2-Aminomalononitrile 4-methylbenzenesulfonate | SB18326 | Aminomalonitrile toluene-4-sulfonate | MFCD00012848 | FT-0622292 | 2-Aminomalononitrile 4-methylbenzenesulfonate | 2-Aminomalononitrile toluene-4-sulfonate | A
Especificaciones y pureza
≥98%(T)
Condiciones de almacenamiento de almacenamiento
Store at -20°C, Argon charged
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥98%(T)
Nombres e identificadores
Pubchem Sid488190316
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488190316
Sonrisas canónicasCC1=CC=C(C=C1)S(=O)(=O)O.C(#N)C(C#N)N
IUPAC Name2-aminopropanedinitrile;4-methylbenzenesulfonic acid
InChIKeyMEUWQVWJLLBVQI-UHFFFAOYSA-N
INCHI1S/C7H8O3S.C3H3N3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3H,6H2
Isómeros SMILES CC1=CC=C(C=C1)S(=O)(=O)O.C(#N)C(C#N)N
WGK Alemania 3
Peso molecular 253.28
Beilstein 4050750
Reaxy-Rn 4050747
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4050747&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 nitrogen compounds
ClaseOrganonitrogen compounds
SubclassOrganic cyanides
Intermediate Tree Nodes Nitriles
Direct ParentAlpha-aminonitriles
Alternative Parents Organopnictogen compounds  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkNot available
Substituents Alpha-aminonitrile - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as alpha-aminonitriles. These are organonitrogen compounds that contain an amino group located on the carbon at the position alpha to a carbonitrile group. They have the general formula RC(NH2)C#N, where the amine group can be substituted.
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.

11 results found

Lot NumberCertificate TypeFechaArticulo
C2204109Certificate of AnalysisDec 12, 2025 A151543
C2204112Certificate of AnalysisDec 12, 2025 A151543
C2204268Certificate of AnalysisDec 12, 2025 A151543
C2204290Certificate of AnalysisDec 12, 2025 A151543
C2204291Certificate of AnalysisDec 12, 2025 A151543
C2204103Certificate of AnalysisFeb 09, 2022 A151543
C2307256Certificate of AnalysisFeb 09, 2022 A151543
C2307265Certificate of AnalysisFeb 09, 2022 A151543
C2307267Certificate of AnalysisFeb 09, 2022 A151543
C2307268Certificate of AnalysisFeb 09, 2022 A151543
C2307273Certificate of AnalysisFeb 09, 2022 A151543

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Propiedades químicas y físicas
SolubilidadSoluble in water
SensibilidadHygroscopic,Heat Sensitive
Punto de fusión (°C)164 °C(dec.)
Peso molecular253.280 g/mol
XLogP3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass253.052 Da
Monoisotopic Mass253.052 Da
Topological Polar Surface Area136.000 Ų
Heavy Atom Count17
Formal Charge0
Complexity310.000
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 Count2
Calculadoras de soluciones
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