2-Methylglutaronitrile - ≥98%(GC) , CAS No.4553-62-2

CAS: 4553-62-2 Cat. No.: M158303 Formula: C6H8N2 Peso molecolare: 108.14 Numero EC: 224-923-5
Disponibile su ordine
GRADE & PURITY ≥98%(GC)
Synonyms
alpha-Methylglutarsaeuredinitril [German] | .alpha.-Methylglutaronitrile | DTXSID4025612 | EJX3MSL725 | Glutaronitrile, 2-methyl- | HMS3039E08 | Q25385993 | AMY40818 | EINECS 224-923-5 | 2-Methylglutaronitrile, 99% | 1,3-Dicyanobutane | 4-02-00-01990 (Bei
Storage
Room temperature
Shipped In
Normal
★
Size
Germania (EU)
USA*
Price
Qty
5g
M158303-5g
—
5 Disponibile
8,59€
25g
M158303-25g
—
3 Disponibile

9,46€

14,66€
Salva 5,21 € (35.50%)
100g
M158303-100g
—
1 Disponibile

30,28€

45,90€
Salva 15,62 € (34.03%)
500g
M158303-500g
—
1 Disponibile
156,11€
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(GC) 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.

Panoramica

product description:

2-Methylglutaronitrile (MGN) is an aliphatic dinitrile. It is a high boiling solvent mainly used in the fiber industry. It is formed as a byproduct during the synthesis of adiponitrile. Synthesis of β-picoline using a mixture of 2-methylglutaronitrile and 2-ethylsuccinonitrile in the presence of silica-supported palladium, rhodium and platinum catalysts by vapour phase hydrogenation has been studied.Its core electron binding energy (CEBE) has been calculated via density functional theory (DFT). It has been reported to undergo hydrolysis catalyzed by nitrilase to form 4-cyanopentanoic acid.

 

application:

2-Methylglutaronitrile (MGN) may be used in the synthesis of 1,5-dimethyl-2-piperidone (1,5-DMPD) by chemoenzymatic process.

 

Specifications

Sinonimi
alpha-Methylglutarsaeuredinitril [German] | .alpha.-Methylglutaronitrile | DTXSID4025612 | EJX3MSL725 | Glutaronitrile, 2-methyl- | HMS3039E08 | Q25385993 | AMY40818 | EINECS 224-923-5 | 2-Methylglutaronitrile, 99% | 1,3-Dicyanobutane | 4-02-00-01990 (Bei
Specifiche e purezza
≥98%(GC)
Condizioni di conservazione di stoccaggio
Room temperature
Spedito in
Normal
Purezza
≥98%(GC)
Nomi e identificatori
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488182637
Sorrisi canonici
CC(CCC#N)C#N
IUPAC Name
2-methylpentanedinitrile
InChIKey
FPPLREPCQJZDAQ-UHFFFAOYSA-N
INCHI
1S/C6H8N2/c1-6(5-8)3-2-4-7/h6H,2-3H2,1H3
Isomeri SMILES
CC(CCC#N)C#N
WGK Germania
3
RTECS
YV8140000
Numero UN
3276
Gruppo di imballaggio
I
Peso molecolare
108.14
Reaxy-Rn
1741955
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1741955&ln=

Documentazione

📋 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
ClasseOrganonitrogen compounds
SubclassOrganic cyanides
Intermediate Tree Nodes Not available
Direct ParentNitriles
Alternative Parents Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Obiettivi associati (umani)
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Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
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Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Meccanismi d'azione
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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.

22 results found

Lot NumberCertificate TypeDataOggetto
I2617830Certificate of AnalysisSep 07, 2026 M158303
I2617829Certificate of AnalysisSep 07, 2026 M158303
I2617828Certificate of AnalysisSep 07, 2026 M158303
L2103017Certificate of AnalysisSep 09, 2025 M158303
L2102627Certificate of AnalysisSep 09, 2025 M158303
L2102626Certificate of AnalysisSep 09, 2025 M158303
I2519561Certificate of AnalysisJun 18, 2025 M158303
I2519531Certificate of AnalysisJun 18, 2025 M158303
I2519530Certificate of AnalysisJun 18, 2025 M158303
I2519529Certificate of AnalysisJun 18, 2025 M158303
A2112206Certificate of AnalysisNov 14, 2024 M158303
A2112207Certificate of AnalysisNov 14, 2024 M158303
G2403254Certificate of AnalysisMay 22, 2024 M158303
G2403253Certificate of AnalysisMay 22, 2024 M158303
G2403252Certificate of AnalysisMay 22, 2024 M158303
C2016138Certificate of AnalysisJan 18, 2024 M158303
G2617058Certificate of AnalysisJan 03, 2023 M158303
B2328860Certificate of AnalysisJan 03, 2023 M158303
B2328854Certificate of AnalysisJan 03, 2023 M158303
B2328813Certificate of AnalysisJan 03, 2023 M158303
B2328810Certificate of AnalysisJan 03, 2023 M158303
B2328808Certificate of AnalysisJan 03, 2023 M158303
Proprietà chimiche e fisiche
SolubilitàSoluble in water
Indice di rifrazione1.4320 to 1.4350
Punto di infiammabilità (°F)115°C
Punto di infiammabilità (°C)115°C
Punto di ebollizione (°C)135°C/12mmHg
Punto di fusione (°C)−45 °C
Peso molecolare108.140 g/mol
XLogP30.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass108.069 Da
Monoisotopic Mass108.069 Da
Topological Polar Surface Area47.600 Ų
Heavy Atom Count8
Formal Charge0
Complexity142.000
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
Calcolatori di soluzioni
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