3-Methylpyrazole - ≥98% , CAS No.1453-58-3

CAS: 1453-58-3 Cat. No.: M108005 Summenformel: C4H6N2 Molekulargewicht: 82.1 Beilstein Registry Number: 1454 EG-Nummer: 215-925-7
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GRADE & PURITY ≥98%
Synonyms
DTXSID3073260 | MFCD08685900 | 3-Methylpyrazole, analytical reference material | BB 0253954 | CCG-266014 | 5-23-05-00004 (Beilstein Handbook Reference) | HY-66054 | 1H-Pyrazole,5-methyl- | 5-methyl-1H-pyrazole | BDBM50497139 | s5146 | Z450469310 | BCP2386
Storage
Argon charged,Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
5g
M108005-5g
—
2 Auf Lager
8,59€
25g
M108005-25g
—
3 Auf Lager
9,46€
100g
M108005-100g
—
5 Auf Lager

16,40€

25,08€
Speichern 8,68 € (34.60%)
500g
M108005-500g
—
1 Auf Lager

81,48€

122,26€
Speichern 40,78 € (33.36%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Argon charged,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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
DTXSID3073260 | MFCD08685900 | 3-Methylpyrazole, analytical reference material | BB 0253954 | CCG-266014 | 5-23-05-00004 (Beilstein Handbook Reference) | HY-66054 | 1H-Pyrazole,5-methyl- | 5-methyl-1H-pyrazole | BDBM50497139 | s5146 | Z450469310 | BCP2386
Spezifikationen & Reinheit
≥98%
Storage
Argon charged,Room temperature
Verschickt in
Normal
Reinheit
≥98%
Namen und Kennungen
Pubchem Sid488182057
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488182057
Kanonisches LächelnCC1=CC=NN1
IUPAC Name5-methyl-1H-pyrazole
InChIKeyXKVUYEYANWFIJX-UHFFFAOYSA-N
INCHI1S/C4H6N2/c1-4-2-3-5-6-4/h2-3H,1H3,(H,5,6)
Isomere SMILES CC1=CC=NN1
WGK Deutschland 3
RTECS UQ7340000
UN-Nummer 2810
Molekulargewicht 82.1
Beilstein 1454
Reaxy-Rn 605628
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605628&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
KlasseAzoles
SubclassPyrazoles
Intermediate Tree Nodes Not available
Direct ParentPyrazoles
Alternative Parents Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as pyrazoles. These are compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) and three carbon atoms.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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.

9 results found

Lot NumberCertificate TypeDatumArtikel
H2514113Certificate of AnalysisAug 23, 2025 M108005
I1818075Certificate of AnalysisJul 21, 2022 M108005
I1818074Certificate of AnalysisJul 21, 2022 M108005
B2518047Certificate of AnalysisJun 20, 2022 M108005
G2528012Certificate of AnalysisJun 20, 2022 M108005
I2202613Certificate of AnalysisJun 20, 2022 M108005
I2202699Certificate of AnalysisJun 20, 2022 M108005
I2202700Certificate of AnalysisJun 20, 2022 M108005
I2202701Certificate of AnalysisJun 20, 2022 M108005
Chemische und physikalische Eigenschaften
Empfindlichkeitair sensitive
Brechungsindex1.495
Flammpunkt (°F)199.4 °F
Flammpunkt (°C)93 °C
Siedepunkt (°C)204°C
Molekulargewicht82.100 g/mol
XLogP30.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass82.0531 Da
Monoisotopic Mass82.0531 Da
Topological Polar Surface Area28.700 Ų
Heavy Atom Count6
Formal Charge0
Complexity44.800
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
FAQs und Artikel
Citations of This Product
Referenzen
1. Bin Chen, Hegang Shu, Yujun Guo, Yingjie Xu.  (2024)  CO2 capture and viscosity of metal chelate-based ionic liquids: Influence of the structure and substitution of the azole-based anion.  JOURNAL OF MOLECULAR LIQUIDS,      [PMID:] [10.1016/j.molliq.2024.126574]
Lösungsrechner
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Häufig gestellte Fragen

What is the purity of this product?
This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.
How is this product shipped?
This product ships under standard ambient conditions. No temperature-controlled packaging is required.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 1453-58-3, the molecular formula is C4H6N2, and the molecular weight is 82.1 g/mol. InChIKey XKVUYEYANWFIJX-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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